This work introduces a method for high-accuracy EMG based gesture identification. A newly developed deep learning method, namely, deep residual shrinkage network is applied to perform gesture identification. Based on the feature of EMG signal resulting from gestures, optimizations are made to improve the identification accuracy. Finally, three different algorithms are applied to compare the accuracy of EMG signal recognition with that of DRSN. The result shows that DRSN excel traditional neural networks in terms of EMG recognition accuracy. This paper provides a reliable way to classify EMG signals, as well as exploring possible applications of DRSN.  ( 2 min )

Supervised learning has been widely used for attack categorization, requiring high-quality data and labels. However, the data is often imbalanced and it is difficult to obtain sufficient annotations. Moreover, supervised models are subject to real-world deployment issues, such as defending against unseen artificial attacks. To tackle the challenges, we propose a semi-supervised fine-grained attack categorization framework consisting of an encoder and a two-branch structure and this framework can be generalized to different supervised models. The multilayer perceptron with residual connection is used as the encoder to extract features and reduce the complexity. The Recurrent Prototype Module (RPM) is proposed to train the encoder effectively in a semi-supervised manner. To alleviate the data imbalance problem, we introduce the Weight-Task Consistency (WTC) into the iterative process of RPM by assigning larger weights to classes with fewer samples in the loss function. In addition, to cope with new attacks in real-world deployment, we propose an Active Adaption Resampling (AAR) method, which can better discover the distribution of unseen sample data and adapt the parameters of encoder. Experimental results show that our model outperforms the state-of-the-art semi-supervised attack detection methods with a 3% improvement in classification accuracy and a 90% reduction in training time.  ( 3 min )

Understanding the long-term evolution of hierarchical triple systems is challenging due to its inherent chaotic nature, and it requires computationally expensive simulations. Here we propose a convolutional neural network model to predict the stability of hierarchical triples by looking at their evolution during the first $5 \times 10^5$ inner binary orbits. We employ the regularized few-body code TSUNAMI to simulate $5\times 10^6$ hierarchical triples, from which we generate a large training and test dataset. We develop twelve different network configurations that use different combinations of the triples' orbital elements and compare their performances. Our best model uses 6 time-series, namely, the semimajor axes ratio, the inner and outer eccentricities, the mutual inclination and the arguments of pericenter. This model achieves an area under the curve of over $95\%$ and informs of the relevant parameters to study triple systems stability. All trained models are made publicly available, allowing to predict the stability of hierarchical triple systems $200$ times faster than pure $N$-body methods.  ( 3 min )

Recent work has shown logical background knowledge can be used in learning systems to compensate for a lack of labeled training data. Many methods work by creating a loss function that encodes this knowledge. However, often the logic is discarded after training, even if it is still useful at test time. Instead, we ensure neural network predictions satisfy the knowledge by refining the predictions with an extra computation step. We introduce differentiable refinement functions that find a corrected prediction close to the original prediction. We study how to effectively and efficiently compute these refinement functions. Using a new algorithm called Iterative Local Refinement (ILR), we combine refinement functions to find refined predictions for logical formulas of any complexity. ILR finds refinements on complex SAT formulas in significantly fewer iterations and frequently finds solutions where gradient descent can not. Finally, ILR produces competitive results in the MNIST addition task.  ( 2 min )

Each year, expert-level performance is attained in increasingly-complex multiagent domains, notable examples including Go, Poker, and StarCraft II. This rapid progression is accompanied by a commensurate need to better understand how such agents attain this performance, to enable their safe deployment, identify limitations, and reveal potential means of improving them. In this paper we take a step back from performance-focused multiagent learning, and instead turn our attention towards agent behavior analysis. We introduce a model-agnostic method for discovery of behavior clusters in multiagent domains, using variational inference to learn a hierarchy of behaviors at the joint and local agent levels. Our framework makes no assumption about agents' underlying learning algorithms, does not require access to their latent states or policies, and is trained using only offline observational data. We illustrate the effectiveness of our method for enabling the coupled understanding of behaviors at the joint and local agent level, detection of behavior changepoints throughout training, discovery of core behavioral concepts, demonstrate the approach's scalability to a high-dimensional multiagent MuJoCo control domain, and also illustrate that the approach can disentangle previously-trained policies in OpenAI's hide-and-seek domain.  ( 2 min )

This paper proposes a method for the automatic creation of variables (in the case of regression) that complement the information contained in the initial input vector. The method works as a pre-processing step in which the continuous values of the variable to be regressed are discretized into a set of intervals which are then used to define value thresholds. Then classifiers are trained to predict whether the value to be regressed is less than or equal to each of these thresholds. The different outputs of the classifiers are then concatenated in the form of an additional vector of variables that enriches the initial vector of the regression problem. The implemented system can thus be considered as a generic pre-processing tool. We tested the proposed enrichment method with 5 types of regressors and evaluated it in 33 regression datasets. Our experimental results confirm the interest of the approach.  ( 2 min )

With the advent of functional encryption, new possibilities for computation on encrypted data have arisen. Functional Encryption enables data owners to grant third-party access to perform specified computations without disclosing their inputs. It also provides computation results in plain, unlike Fully Homomorphic Encryption. The ubiquitousness of machine learning has led to the collection of massive private data in the cloud computing environment. This raises potential privacy issues and the need for more private and secure computing solutions. Numerous efforts have been made in privacy-preserving machine learning (PPML) to address security and privacy concerns. There are approaches based on fully homomorphic encryption (FHE), secure multiparty computation (SMC), and, more recently, functional encryption (FE). However, FE-based PPML is still in its infancy and has not yet gotten much attention compared to FHE-based PPML approaches. In this paper, we provide a systematization of PPML works based on FE summarizing state-of-the-art in the literature. We focus on Inner-product-FE and Quadratic-FE-based machine learning models for the PPML applications. We analyze the performance and usability of the available FE libraries and their applications to PPML. We also discuss potential directions for FE-based PPML approaches. To the best of our knowledge, this is the first work to systematize FE-based PPML approaches.  ( 3 min )

We address the problem of learning a machine learning model from training data that originates at multiple data owners while providing formal privacy guarantees regarding the protection of each owner's data. Existing solutions based on Differential Privacy (DP) achieve this at the cost of a drop in accuracy. Solutions based on Secure Multiparty Computation (MPC) do not incur such accuracy loss but leak information when the trained model is made publicly available. We propose an MPC solution for training DP models. Our solution relies on an MPC protocol for model training, and an MPC protocol for perturbing the trained model coefficients with Laplace noise in a privacy-preserving manner. The resulting MPC+DP approach achieves higher accuracy than a pure DP approach while providing the same formal privacy guarantees. Our work obtained first place in the iDASH2021 Track III competition on confidential computing for secure genome analysis.  ( 2 min )

Goal-conditioned reinforcement learning (GCRL), related to a set of complex RL problems, trains an agent to achieve different goals under particular scenarios. Compared to the standard RL solutions that learn a policy solely depending on the states or observations, GCRL additionally requires the agent to make decisions according to different goals. In this survey, we provide a comprehensive overview of the challenges and algorithms for GCRL. Firstly, we answer what the basic problems are studied in this field. Then, we explain how goals are represented and present how existing solutions are designed from different points of view. Finally, we make the conclusion and discuss potential future prospects that recent researches focus on.  ( 2 min )

Long-standing data sparsity and cold-start constitute thorny and perplexing problems for the recommendation systems. Cross-domain recommendation as a domain adaptation framework has been utilized to efficiently address these challenging issues, by exploiting information from multiple domains. In this study, an item-level relevance cross-domain recommendation task is explored, where two related domains, that is, the source and the target domain contain common items without sharing sensitive information regarding the users' behavior, and thus avoiding the leak of user privacy. In light of this scenario, two novel coupled autoencoder-based deep learning methods are proposed for cross-domain recommendation. The first method aims to simultaneously learn a pair of autoencoders in order to reveal the intrinsic representations of the items in the source and target domains, along with a coupled mapping function to model the non-linear relationships between these representations, thus transferring beneficial information from the source to the target domain. The second method is derived based on a new joint regularized optimization problem, which employs two autoencoders to generate in a deep and non-linear manner the user and item-latent factors, while at the same time a data-driven function is learnt to map the item-latent factors across domains. Extensive numerical experiments on two publicly available benchmark datasets are conducted illustrating the superior performance of our proposed methods compared to several state-of-the-art cross-domain recommendation frameworks.  ( 3 min )

We propose an algorithm for next query recommendation in interactive data exploration settings, like knowledge discovery for information gathering. The state-of-the-art query recommendation algorithms are based on sequence-to-sequence learning approaches that exploit historical interaction data. Due to the supervision involved in the learning process, such approaches fail to adapt to immediate user feedback. We propose to augment the transformer-based causal language models for query recommendations to adapt to the immediate user feedback using multi-armed bandit (MAB) framework. We conduct a large-scale experimental study using log files from a popular online literature discovery service and demonstrate that our algorithm improves the per-round regret substantially, with respect to the state-of-the-art transformer-based query recommendation models, which do not make use of immediate user feedback. Our data model and source code are available at https://github.com/shampp/exp3_ss  ( 2 min )

We present the extension of the Remember and Forget for Experience Replay (ReF-ER) algorithm to Multi-Agent Reinforcement Learning (MARL). ReF-ER was shown to outperform state of the art algorithms for continuous control in problems ranging from the OpenAI Gym to complex fluid flows. In MARL, the dependencies between the agents are included in the state-value estimator and the environment dynamics are modeled via the importance weights used by ReF-ER. In collaborative environments, we find the best performance when the value is estimated using individual rewards and we ignore the effects of other actions on the transition map. We benchmark the performance of ReF-ER MARL on the Stanford Intelligent Systems Laboratory (SISL) environments. We find that employing a single feed-forward neural network for the policy and the value function in ReF-ER MARL, outperforms state of the art algorithms that rely on complex neural network architectures.  ( 2 min )

Unsupervised image transfer enables intra- and inter-modality image translation in applications where a large amount of paired training data is not abundant. To ensure a structure-preserving mapping from the input to the target domain, existing methods for unpaired image transfer are commonly based on cycle-consistency, causing additional computational resources and instability due to the learning of an inverse mapping. This paper presents a novel method for uni-directional domain mapping that does not rely on any paired training data. A proper transfer is achieved by using a GAN architecture and a novel generator loss based on patch invariance. To be more specific, the generator outputs are evaluated and compared at different scales, also leading to an increased focus on high-frequency details as well as an implicit data augmentation. This novel patch loss also offers the possibility to accurately predict aleatoric uncertainty by modeling an input-dependent scale map for the patch residuals. The proposed method is comprehensively evaluated on three well-established medical databases. As compared to four state-of-the-art methods, we observe significantly higher accuracy on these datasets, indicating great potential of the proposed method for unpaired image transfer with uncertainty taken into account. Implementation of the proposed framework is released here: \url{https://github.com/anger-man/unsupervised-image-transfer-and-uq}.  ( 3 min )

Echocardiography image quality assessment is not a trivial issue in transthoracic examination. As the in vivo examination of heart structures gained prominence in cardiac diagnosis, it has been affirmed that accurate diagnosis of the left ventricle functions is hugely dependent on the quality of echo images. Up till now, visual assessment of echo images is highly subjective and requires specific definition under clinical pathologies. While poor-quality images impair quantifications and diagnosis, the inherent variations in echocardiographic image quality standards indicates the complexity faced among different observers and provides apparent evidence for incoherent assessment under clinical trials, especially with less experienced cardiologists. In this research, our aim was to analyse and define specific quality attributes mostly discussed by experts and present a fully trained convolutional neural network model for assessing such quality features objectively.  ( 2 min )

Modern Internet of Things (IoT) environments are monitored via a large number of IoT enabled sensing devices, with the data acquisition and processing infrastructure setting restrictions in terms of computational power and energy resources. To alleviate this issue, sensors are often configured to operate at relatively low sampling frequencies, yielding a reduced set of observations. Nevertheless, this can hamper dramatically subsequent decision-making, such as forecasting. To address this problem, in this work we evaluate short-term forecasting in highly underdetermined cases, i.e., the number of sensor streams is much higher than the number of observations. Several statistical, machine learning and neural network-based models are thoroughly examined with respect to the resulting forecasting accuracy on five different real-world datasets. The focus is given on a unified experimental protocol especially designed for short-term prediction of multiple time series at the IoT edge. The proposed framework can be considered as an important step towards establishing a solid forecasting strategy in resource constrained IoT applications.  ( 2 min )

We study the problem of estimating the density $f(\boldsymbol x)$ of a random vector ${\boldsymbol X}$ in $\mathbb R^d$. For a spanning tree $T$ defined on the vertex set $\{1,\dots ,d\}$, the tree density $f_{T}$ is a product of bivariate conditional densities. An optimal spanning tree minimizes the Kullback-Leibler divergence between $f$ and $f_{T}$. From i.i.d. data we identify an optimal tree $T^*$ and efficiently construct a tree density estimate $f_n$ such that, without any regularity conditions on the density $f$, one has $\lim_{n\to \infty} \int |f_n(\boldsymbol x)-f_{T^*}(\boldsymbol x)|d\boldsymbol x=0$ a.s. For Lipschitz $f$ with bounded support, $\mathbb E \left\{ \int |f_n(\boldsymbol x)-f_{T^*}(\boldsymbol x)|d\boldsymbol x\right\}=O\big(n^{-1/4}\big)$, a dimension-free rate.

Databases covering all individuals of a population are increasingly used for research and decision-making. The massive size of such databases is often mistaken as a guarantee for valid inferences. However, population data have characteristics that make them challenging to use. Various assumptions on population coverage and data quality are commonly made, including how such data were captured and what types of processing have been applied to them. Furthermore, the full potential of population data can often only be unlocked when such data are linked to other databases. Record linkage often implies subtle technical problems, which are easily missed. We discuss a diverse range of misconceptions relevant for anybody capturing, processing, linking, or analysing population data. Remarkably many of these misconceptions are due to the social nature of data collections and are therefore missed by purely technical accounts of data processing. Many of these misconceptions are also not well documented in scientific publications. We conclude with a set of recommendations for using population data.

Reverse Engineering a CAD shape from other representations is an important geometric processing step for many downstream applications. In this work, we introduce a novel neural network architecture to solve this challenging task and approximate a smoothed signed distance function with an editable, constrained, prismatic CAD model. During training, our method reconstructs the input geometry in the voxel space by decomposing the shape into a series of 2D profile images and 1D envelope functions. These can then be recombined in a differentiable way allowing a geometric loss function to be defined. During inference, we obtain the CAD data by first searching a database of 2D constrained sketches to find curves which approximate the profile images, then extrude them and use Boolean operations to build the final CAD model. Our method approximates the target shape more closely than other methods and outputs highly editable constrained parametric sketches which are compatible with existing CAD software.

We study one of the key tools in data approximation and optimization: low-discrepancy colorings. Formally, given a finite set system $(X,\mathcal S)$, the \emph{discrepancy} of a two-coloring $\chi:X\to\{-1,1\}$ is defined as $\max_{S \in \mathcal S}|{\chi(S)}|$, where $\chi(S)=\sum\limits_{x \in S}\chi(x)$. We propose a randomized algorithm which, for any $d>0$ and $(X,\mathcal S)$ with dual shatter function $\pi^*(k)=O(k^d)$, returns a coloring with expected discrepancy $O\left({\sqrt{|X|^{1-1/d}\log|\mathcal S|}}\right)$ (this bound is tight) in time $\tilde O\left({|\mathcal S|\cdot|X|^{1/d}+|X|^{2+1/d}}\right)$, improving upon the previous-best time of $O\left(|\mathcal S|\cdot|X|^3\right)$ by at least a factor of $|X|^{2-1/d}$ when $|\mathcal S|\geq|X|$. This setup includes many geometric classes, families of bounded dual VC-dimension, and others. As an immediate consequence, we obtain an improved algorithm to construct $\varepsilon$-approximations of sub-quadratic size. Our method uses primal-dual reweighing with an improved analysis of randomly updated weights and exploits the structural properties of the set system via matchings with low crossing number -- a fundamental structure in computational geometry. In particular, we get the same $|X|^{2-1/d}$ factor speed-up on the construction time of matchings with crossing number $O\left({|X|^{1-1/d}}\right)$, which is the first improvement since the 1980s. The proposed algorithms are very simple, which makes it possible, for the first time, to compute colorings with near-optimal discrepancies and near-optimal sized approximations for abstract and geometric set systems in dimensions higher than $2$.

Domain Generalization (DG) studies the capability of a deep learning model to generalize to out-of-training distributions. In the last decade, literature has been massively filled with a collection of training methodologies that claim to obtain more abstract and robust data representations to tackle domain shifts. Recent research has provided a reproducible benchmark for DG, pointing out the effectiveness of naive empirical risk minimization (ERM) over existing algorithms. Nevertheless, researchers persist in using the same outdated feature extractors, and no attention has been given to the effects of different backbones yet. In this paper, we start back to backbones proposing a comprehensive analysis of their intrinsic generalization capabilities, so far ignored by the research community. We evaluate a wide variety of feature extractors, from standard residual solutions to transformer-based architectures, finding an evident linear correlation between large-scale single-domain classification accuracy and DG capability. Our extensive experimentation shows that by adopting competitive backbones in conjunction with effective data augmentation, plain ERM outperforms recent DG solutions and achieves state-of-the-art accuracy. Moreover, our additional qualitative studies reveal that novel backbones give more similar representations to same-class samples, separating different domains in the feature space. This boost in generalization capabilities leaves marginal room for DG algorithms and suggests a new paradigm for investigating the problem, placing backbones in the spotlight and encouraging the development of consistent algorithms on top of them.

With the fast adoption of machine learning (ML) techniques, sharing of ML models is becoming popular. However, ML models are vulnerable to privacy attacks that leak information about the training data. In this work, we focus on a particular type of privacy attacks named property inference attack (PIA) which infers the sensitive properties of the training data through the access to the target ML model. In particular, we consider Graph Neural Networks (GNNs) as the target model, and distribution of particular groups of nodes and links in the training graph as the target property. While the existing work has investigated PIAs that target at graph-level properties, no prior works have studied the inference of node and link properties at group level yet. In this work, we perform the first systematic study of group property inference attacks (GPIA) against GNNs. First, we consider a taxonomy of threat models under both black-box and white-box settings with various types of adversary knowledge, and design six different attacks for these settings. We evaluate the effectiveness of these attacks through extensive experiments on three representative GNN models and three real-world graphs. Our results demonstrate the effectiveness of these attacks whose accuracy outperforms the baseline approaches. Second, we analyze the underlying factors that contribute to GPIA's success, and show that the target model trained on the graphs with or without the target property represents some dissimilarity in model parameters and/or model outputs, which enables the adversary to infer the existence of the property. Further, we design a set of defense mechanisms against the GPIA attacks, and demonstrate that these mechanisms can reduce attack accuracy effectively with small loss on GNN model accuracy.

One of the key challenges of learning an online recommendation model is the temporal domain shift, which causes the mismatch between the training and testing data distribution and hence domain generalization error. To overcome, we propose to learn a meta future gradient generator that forecasts the gradient information of the future data distribution for training so that the recommendation model can be trained as if we were able to look ahead at the future of its deployment. Compared with Batch Update, a widely used paradigm, our theory suggests that the proposed algorithm achieves smaller temporal domain generalization error measured by a gradient variation term in a local regret. We demonstrate the empirical advantage by comparing with various representative baselines.

Multi-server queueing systems are widely used models for job scheduling in machine learning, wireless networks, and crowdsourcing. This paper considers a multi-server system with multiple servers and multiple types of jobs. The system maintains a separate queue for each type of jobs. For each time slot, each available server picks a job from a queue and then serves the job until it is complete. The arrival rates of the queues and the mean service times are unknown and even nonstationary. We propose the MaxWeight with discounted upper confidence bound (UCB) algorithm, which simultaneously learns the statistics and schedules jobs to servers. We prove that the proposed algorithm can stabilize the queues when the arrival rates are strictly within the service capacity region. Specifically, we prove that the queue lengths are bounded in the mean under the assumption that the mean service times change relatively slowly over time and the arrival rates are bounded away from the capacity region by a constant whose value depends on the discount factor used in the discounted UCB. Simulation results confirm that the proposed algorithm can stabilize the queues and that it outperforms MaxWeight with empirical mean and MaxWeight with discounted empirical mean. The proposed algorithm is also better than MaxWeight with UCB in the nonstationary setting.

Reinforcement learning algorithms require a large amount of samples; this often limits their real-world applications on even simple tasks. Such a challenge is more outstanding in multi-agent tasks, as each step of operation is more costly requiring communications or shifting or resources. This work aims to improve data efficiency of multi-agent control by model-based learning. We consider networked systems where agents are cooperative and communicate only locally with their neighbors, and propose the decentralized model-based policy optimization framework (DMPO). In our method, each agent learns a dynamic model to predict future states and broadcast their predictions by communication, and then the policies are trained under the model rollouts. To alleviate the bias of model-generated data, we restrain the model usage for generating myopic rollouts, thus reducing the compounding error of model generation. To pertain the independence of policy update, we introduce extended value function and theoretically prove that the resulting policy gradient is a close approximation to true policy gradients. We evaluate our algorithm on several benchmarks for intelligent transportation systems, which are connected autonomous vehicle control tasks (Flow and CACC) and adaptive traffic signal control (ATSC). Empirically results show that our method achieves superior data efficiency and matches the performance of model-free methods using true models.

Benefiting from the message passing mechanism, Graph Neural Networks (GNNs) have been successful on flourish tasks over graph data. However, recent studies have shown that attackers can catastrophically degrade the performance of GNNs by maliciously modifying the graph structure. A straightforward solution to remedy this issue is to model the edge weights by learning a metric function between pairwise representations of two end nodes, which attempts to assign low weights to adversarial edges. The existing methods use either raw features or representations learned by supervised GNNs to model the edge weights. However, both strategies are faced with some immediate problems: raw features cannot represent various properties of nodes (e.g., structure information), and representations learned by supervised GNN may suffer from the poor performance of the classifier on the poisoned graph. We need representations that carry both feature information and as mush correct structure information as possible and are insensitive to structural perturbations. To this end, we propose an unsupervised pipeline, named STABLE, to optimize the graph structure. Finally, we input the well-refined graph into a downstream classifier. For this part, we design an advanced GCN that significantly enhances the robustness of vanilla GCN without increasing the time complexity. Extensive experiments on four real-world graph benchmarks demonstrate that STABLE outperforms the state-of-the-art methods and successfully defends against various attacks.

Planar graph drawings tend to be aesthetically pleasing. In this poster we explore a Neural Network's capability of learning various planar graph classes. Additionally, we also investigate the effectiveness of the model in generalizing beyond planarity. We find that the model can outperform conventional techniques for certain graph classes. The model, however, appears to be more susceptible to randomness in the data, and seems to be less robust than expected.

In the context of modern environmental and societal concerns, there is an increasing demand for methods able to identify management strategies for civil engineering systems, minimizing structural failure risks while optimally planning inspection and maintenance (I&M) processes. Most available methods simplify the I&M decision problem to the component level due to the computational complexity associated with global optimization methodologies under joint system-level state descriptions. In this paper, we propose an efficient algorithmic framework for inference and decision-making under uncertainty for engineering systems exposed to deteriorating environments, providing optimal management strategies directly at the system level. In our approach, the decision problem is formulated as a factored partially observable Markov decision process, whose dynamics are encoded in Bayesian network conditional structures. The methodology can handle environments under equal or general, unequal deterioration correlations among components, through Gaussian hierarchical structures and dynamic Bayesian networks. In terms of policy optimization, we adopt a deep decentralized multi-agent actor-critic (DDMAC) reinforcement learning approach, in which the policies are approximated by actor neural networks guided by a critic network. By including deterioration dependence in the simulated environment, and by formulating the cost model at the system level, DDMAC policies intrinsically consider the underlying system-effects. This is demonstrated through numerical experiments conducted for both a 9-out-of-10 system and a steel frame under fatigue deterioration. Results demonstrate that DDMAC policies offer substantial benefits when compared to state-of-the-art heuristic approaches. The inherent consideration of system-effects by DDMAC strategies is also interpreted based on the learned policies.

Black-box optimization has potential in numerous applications such as hyperparameter optimization in machine learning and optimization in design of experiments. Ising machines are useful for binary optimization problems because variables can be represented by a single binary variable of Ising machines. However, conventional approaches using an Ising machine cannot handle black-box optimization problems with non-binary values. To overcome this limitation, we propose an approach for integer-variable black-box optimization problems by using Ising/annealing machines and factorization machines in cooperation with three different integer-encoding methods. The performance of our approach is numerically evaluated with different encoding methods using a simple problem of calculating the energy of the hydrogen molecule in the most stable state. The proposed approach can calculate the energy using any of the integer-encoding methods. However, one-hot encoding is useful for problems with a small size.

Classifications organize entities into categories that identify similarities within a category and discern dissimilarities among categories, and they powerfully classify information in support of analysis. We propose a new classification scheme premised on the reality of imperfect data. Our computational model uses uncertain data envelopment analysis to define a classification's proximity to equitable efficiency, which is an aggregate measure of intra-similarity within a classification's categories. Our classification process has two overriding computational challenges, those being a loss of convexity and a combinatorially explosive search space. We overcome the first by establishing lower and upper bounds on the proximity value, and then by searching this range with a first-order algorithm. We overcome the second by adapting the p-median problem to initiate our exploration, and by then employing an iterative neighborhood search to finalize a classification. We conclude by classifying the thirty stocks in the Dow Jones Industrial average into performant tiers and by classifying prostate treatments into clinically effectual categories.

Machine learning (ML) has significantly contributed to the development of bioprocess engineering, but its application is still limited, hampering the enormous potential for bioprocess automation. ML for model building automation can be seen as a way of introducing another level of abstraction to focus expert humans in the most cognitive tasks of bioprocess development. First, probabilistic programming is used for the autonomous building of predictive models. Second, machine learning automatically assesses alternative decisions by planning experiments to test hypotheses and conducting investigations to gather informative data that focus on model selection based on the uncertainty of model predictions. This review provides a comprehensive overview of ML-based automation in bioprocess development. On the one hand, the biotech and bioengineering community should be aware of the potential and, most importantly, the limitation of existing ML solutions for their application in biotechnology and biopharma. On the other hand, it is essential to identify the missing links to enable the easy implementation of ML and Artificial Intelligence (AI) solutions in valuable solutions for the bio-community. We summarize recent ML implementation across several important subfields of bioprocess systems and raise two crucial challenges remaining the bottleneck of bioprocess automation and reducing uncertainty in biotechnology development. There is no one-fits-all procedure; however, this review should help identify the potential automation combining biotechnology and ML domains.

Temporal networks have been widely used to model real-world complex systems such as financial systems and e-commerce systems. In a temporal network, the joint neighborhood of a set of nodes often provides crucial structural information on predicting whether they may interact at a certain time. However, recent representation learning methods for temporal networks often fail to extract such information or depend on extremely time-consuming feature construction approaches. To address the issue, this work proposes Neighborhood-Aware Temporal network model (NAT). For each node in the network, NAT abandons the commonly-used one-single-vector-based representation while adopting a novel dictionary-type neighborhood representation. Such a dictionary representation records a down-sampled set of the neighboring nodes as keys, and allows fast construction of structural features for a joint neighborhood of multiple nodes. We also design dedicated data structure termed N-cache to support parallel access and update of those dictionary representations on GPUs. NAT gets evaluated over seven real-world large-scale temporal networks. NAT not only outperforms all cutting-edge baselines by averaged 5.9% and 6.0% in transductive and inductive link prediction accuracy, respectively, but also keeps scalable by achieving a speed-up of 4.1-76.7 against the baselines that adopts joint structural features and achieves a speed-up of 1.6-4.0 against the baselines that cannot adopt those features. The link to the code: https://github.com/Graph-COM/Neighborhood-Aware-Temporal-Network.

Privacy attacks on Machine Learning (ML) models often focus on inferring the existence of particular data points in the training data. However, what the adversary really wants to know is if a particular \emph{individual}'s (\emph{subject}'s) data was included during training. In such scenarios, the adversary is more likely to have access to the distribution of a particular subject, than actual records. Furthermore, in settings like cross-silo Federated Learning (FL), a subject's data can be embodied by multiple data records that are spread across multiple organizations. Nearly all of the existing private FL literature is dedicated to studying privacy at two granularities -- item-level (individual data records), and user-level (participating user in the federation), neither of which apply to data subjects in cross-silo FL. This insight motivates us to shift our attention from the privacy of data records to the privacy of \emph{data subjects}, also known as subject-level privacy. We propose two black-box attacks for \emph{subject membership inference}, of which one assumes access to a model after each training round. Using these attacks, we estimate subject membership inference risk on real-world data for single-party models as well as FL scenarios. We find our attacks to be extremely potent, even without access to exact training records, and using the knowledge of membership for a handful of subjects. To better understand the various factors that may influence subject privacy risk in cross-silo FL settings, we systematically generate several hundred synthetic federation configurations, varying properties of the data, model design and training, and the federation itself. Finally, we investigate the effectiveness of Differential Privacy in mitigating this threat.

The rapid analysis of thermal stress and deformation plays a pivotal role in the thermal control measures and optimization of the structural design of satellites. For achieving real-time thermal stress and thermal deformation analysis of satellite motherboards, this paper proposes a novel Multi-Task Attention UNet (MTA-UNet) neural network which combines the advantages of both Multi-Task Learning (MTL) and U-Net with attention mechanism. Besides, a physics-informed strategy is used in the training process, where partial differential equations (PDEs) are integrated into the loss functions as residual terms. Finally, an uncertainty-based loss balancing approach is applied to weight different loss functions of multiple training tasks. Experimental results show that the proposed MTA-UNet effectively improves the prediction accuracy of multiple physics tasks compared with Single-Task Learning (STL) models. In addition, the physics-informed method brings less error in the prediction of each task, especially on small data sets. The code can be downloaded at: \url{https://github.com/KomorebiTso/MTA-UNet}.

The sense of touch is essential for a variety of daily tasks. New advances in event-based tactile sensors and Spiking Neural Networks (SNNs) spur the research in event-driven tactile learning. However, SNN-enabled event-driven tactile learning is still in its infancy due to the limited representative abilities of existing spiking neurons and high spatio-temporal complexity in the data. In this paper, to improve the representative capabilities of existing spiking neurons, we propose a novel neuron model called "location spiking neuron", which enables us to extract features of event-based data in a novel way. Moreover, based on the classical Time Spike Response Model (TSRM), we develop a specific location spiking neuron model - Location Spike Response Model (LSRM) that serves as a new building block of SNNs. Furthermore, we propose a hybrid model which combines an SNN with TSRM neurons and an SNN with LSRM neurons to capture the complex spatio-temporal dependencies in the data. Extensive experiments demonstrate the significant improvements of our models over other works on event-driven tactile learning and show the superior energy efficiency of our models and location spiking neurons, which may unlock their potential on neuromorphic hardware.

Climate change increases the number of extreme weather events (wind and snowstorms, heavy rains, wildfires) that compromise power system reliability and lead to multiple equipment failures. Real-time and accurate detecting of potential line failures is the first step to mitigating the extreme weather impact and activating emergency controls. Power balance equations nonlinearity, increased uncertainty in generation during extreme events, and lack of grid observability compromise the efficiency of traditional data-driven failure detection methods. At the same time, modern problem-oblivious machine learning methods based on neural networks require a large amount of data to detect an accident, especially in a time-changing environment. This paper proposes a Physics-InformEd Line failure Detector (FIELD) that leverages grid topology information to reduce sample and time complexities and improve localization accuracy. Finally, we illustrate the superior empirical performance of our approach compared to state-of-the-art methods over various test cases.

Centralised training (CT) is the basis for many popular multi-agent reinforcement learning (MARL) methods because it allows agents to quickly learn high-performing policies. However, CT relies on agents learning from one-off observations of other agents' actions at a given state. Because MARL agents explore and update their policies during training, these observations often provide poor predictions about other agents' behaviour and the expected return for a given action. CT methods therefore suffer from high variance and error-prone estimates, harming learning. CT methods also suffer from explosive growth in complexity due to the reliance on global observations, unless strong factorisation restrictions are imposed (e.g., monotonic reward functions for QMIX). We address these challenges with a new semi-centralised MARL framework that performs policy-embedded training and decentralised execution. Our method, policy embedded reinforcement learning algorithm (PERLA), is an enhancement tool for Actor-Critic MARL algorithms that leverages a novel parameter sharing protocol and policy embedding method to maintain estimates that account for other agents' behaviour. Our theory proves PERLA dramatically reduces the variance in value estimates. Unlike various CT methods, PERLA, which seamlessly adopts MARL algorithms, scales easily with the number of agents without the need for restrictive factorisation assumptions. We demonstrate PERLA's superior empirical performance and efficient scaling in benchmark environments including StarCraft Micromanagement II and Multi-agent Mujoco

We introduce a machine-learning framework named statistics-informed neural network (SINN) for learning stochastic dynamics from data. This new architecture was theoretically inspired by a universal approximation theorem for stochastic systems, which we introduce in this paper, and the projection-operator formalism for stochastic modeling. We devise mechanisms for training the neural network model to reproduce the correct \emph{statistical} behavior of a target stochastic process. Numerical simulation results demonstrate that a well-trained SINN can reliably approximate both Markovian and non-Markovian stochastic dynamics. We demonstrate the applicability of SINN to coarse-graining problems and the modeling of transition dynamics. Furthermore, we show that the obtained reduced-order model can be trained on temporally coarse-grained data and hence is well suited for rare-event simulations.

In this work, we ask for and answer what makes classical reinforcement learning cooperative. Cooperating in social dilemma situations is vital for animals, humans, and machines. While evolutionary theory revealed a range of mechanisms promoting cooperation, the conditions under which agents learn to cooperate are contested. Here, we demonstrate which and how individual elements of the multi-agent learning setting lead to cooperation. Specifically, we consider the widely used temporal-difference reinforcement learning algorithm with epsilon-greedy exploration in the classic environment of an iterated Prisoner's dilemma with one-period memory. Each of the two learning agents learns a strategy that conditions the following action choices on both agents' action choices of the last round. We find that next to a high caring for future rewards, a low exploration rate, and a small learning rate, it is primarily intrinsic stochastic fluctuations of the reinforcement learning process which double the final rate of cooperation to up to 80\%. Thus, inherent noise is not a necessary evil of the iterative learning process. It is a critical asset for the learning of cooperation. However, we also point out the trade-off between a high likelihood of cooperative behavior and achieving this in a reasonable amount of time. Our findings are relevant for purposefully designing cooperative algorithms and regulating undesired collusive effects.

We study the effect of normalization on the layers of deep neural networks of feed-forward type. A given layer $i$ with $N_{i}$ hidden units is allowed to be normalized by $1/N_{i}^{\gamma_{i}}$ with $\gamma_{i}\in[1/2,1]$ and we study the effect of the choice of the $\gamma_{i}$ on the statistical behavior of the neural network's output (such as variance) as well as on the test accuracy on the MNIST data set. We find that in terms of variance of the neural network's output and test accuracy the best choice is to choose the $\gamma_{i}$'s to be equal to one, which is the mean-field scaling. We also find that this is particularly true for the outer layer, in that the neural network's behavior is more sensitive in the scaling of the outer layer as opposed to the scaling of the inner layers. The mechanism for the mathematical analysis is an asymptotic expansion for the neural network's output. An important practical consequence of the analysis is that it provides a systematic and mathematically informed way to choose the learning rate hyperparameters. Such a choice guarantees that the neural network behaves in a statistically robust way as the $N_i$ grow to infinity.

In this paper, we propose a self-supervised learning solution for human activity recognition with smartphone accelerometer data. We aim to develop a model that learns strong representations from accelerometer signals, in order to perform robust human activity classification, while reducing the model's reliance on class labels. Specifically, we intend to enable cross-dataset transfer learning such that our network pre-trained on a particular dataset can perform effective activity classification on other datasets (successive to a small amount of fine-tuning). To tackle this problem, we design our solution with the intention of learning as much information from the accelerometer signals as possible. As a result, we design two separate pipelines, one that learns the data in time-frequency domain, and the other in time-domain alone. In order to address the issues mentioned above in regards to cross-dataset transfer learning, we use self-supervised contrastive learning to train each of these streams. Next, each stream is fine-tuned for final classification, and eventually the two are fused to provide the final results. We evaluate the performance of the proposed solution on three datasets, namely MotionSense, HAPT, and HHAR, and demonstrate that our solution outperforms prior works in this field. We further evaluate the performance of the method in learning generalized features, by using MobiAct dataset for pre-training and the remaining three datasets for the downstream classification task, and show that the proposed solution achieves better performance in comparison with other self-supervised methods in cross-dataset transfer learning.

This paper investigates theoretical properties of subsampling and hashing as tools for approximate Euclidean norm-preserving embeddings for vectors with (unknown) additive Gaussian noises. Such embeddings are sometimes called Johnson-lindenstrauss embeddings due to their celebrated lemma. Previous work shows that as sparse embeddings, the success of subsampling and hashing closely depends on the $l_\infty$ to $l_2$ ratios of the vector to be mapped. This paper shows that the presence of noise removes such constrain in high-dimensions, in other words, sparse embeddings such as subsampling and hashing with comparable embedding dimensions to dense embeddings have similar approximate norm-preserving dimensionality-reduction properties. The key is that the noise should be treated as an information to be exploited, not simply something to be removed. Theoretical bounds for subsampling and hashing to recover the approximate norm of a high dimension vector in the presence of noise are derived, with numerical illustrations showing better performances are achieved in the presence of noise.

Multimodal information is frequently available in medical tasks. By combining information from multiple sources, clinicians are able to make more accurate judgments. In recent years, multiple imaging techniques have been used in clinical practice for retinal analysis: 2D fundus photographs, 3D optical coherence tomography (OCT) and 3D OCT angiography, etc. Our paper investigates three multimodal information fusion strategies based on deep learning to solve retinal analysis tasks: early fusion, intermediate fusion, and hierarchical fusion. The commonly used early and intermediate fusions are simple but do not fully exploit the complementary information between modalities. We developed a hierarchical fusion approach that focuses on combining features across multiple dimensions of the network, as well as exploring the correlation between modalities. These approaches were applied to glaucoma and diabetic retinopathy classification, using the public GAMMA dataset (fundus photographs and OCT) and a private dataset of PlexElite 9000 (Carl Zeis Meditec Inc.) OCT angiography acquisitions, respectively. Our hierarchical fusion method performed the best in both cases and paved the way for better clinical diagnosis.

Motivation: The development of novel compounds targeting proteins of interest is one of the most important tasks in the pharmaceutical industry. Deep generative models have been applied to targeted molecular design and have shown promising results. Recently, target-specific molecule generation has been viewed as a translation between the protein language and the chemical language. However, such a model is limited by the availability of interacting protein-ligand pairs. On the other hand, large amounts of unlabeled protein sequences and chemical compounds are available and have been used to train language models that learn useful representations. In this study, we propose exploiting pretrained biochemical language models to initialize (i.e. warm start) targeted molecule generation models. We investigate two warm start strategies: (i) a one-stage strategy where the initialized model is trained on targeted molecule generation (ii) a two-stage strategy containing a pre-finetuning on molecular generation followed by target specific training. We also compare two decoding strategies to generate compounds: beam search and sampling. Results: The results show that the warm-started models perform better than a baseline model trained from scratch. The two proposed warm-start strategies achieve similar results to each other with respect to widely used metrics from benchmarks. However, docking evaluation of the generated compounds for a number of novel proteins suggests that the one-stage strategy generalizes better than the two-stage strategy. Additionally, we observe that beam search outperforms sampling in both docking evaluation and benchmark metrics for assessing compound quality. Availability and implementation: The source code is available at https://github.com/boun-tabi/biochemical-lms-for-drug-design and the materials are archived in Zenodo at https://doi.org/10.5281/zenodo.6832145

The number of IoT devices in healthcare is expected to rise sharply due to increased demand since the COVID-19 pandemic. Deep learning and IoT devices are being employed to monitor body vitals and automate anomaly detection in clinical and non-clinical settings. Most of the current technology requires the transmission of raw data to a remote server, which is not efficient for resource-constrained IoT devices and embedded systems. Additionally, it is challenging to develop a machine learning model for ECG classification due to the lack of an extensive open public database. To an extent, to overcome this challenge PTB-XL dataset has been used. In this work, we have developed machine learning models to be deployed on Raspberry Pi. We present an evaluation of our TensorFlow Model with two classification classes. We also present the evaluation of the corresponding TensorFlow Lite FlatBuffers to demonstrate their minimal run-time requirements while maintaining acceptable accuracy.

Many data analysis tasks heavily rely on a deep understanding of tables (multi-dimensional data). Across the tasks, there exist comonly used metadata attributes of table fields / columns. In this paper, we identify four such analysis metadata: Measure/dimension dichotomy, common field roles, semantic field type, and default aggregation function. While those metadata face challenges of insufficient supervision signals, utilizing existing knowledge and understanding distribution. To inference these metadata for a raw table, we propose our multi-tasking Metadata model which fuses field distribution and knowledge graph information into pre-trained tabular models. For model training and evaluation, we collect a large corpus (~582k tables from private spreadsheet and public tabular datasets) of analysis metadata by using diverse smart supervisions from downstream tasks. Our best model has accuracy = 98%, hit rate at top-1 > 67%, accuracy > 80%, and accuracy = 88% for the four analysis metadata inference tasks, respectively. It outperforms a series of baselines that are based on rules, traditional machine learning methods, and pre-trained tabular models. Analysis metadata models are deployed in a popular data analysis product, helping downstream intelligent features such as insights mining, chart / pivot table recommendation, and natural language QA...

The state identification problem seeks to identify power usage patterns of any system, like buildings or factories, of interest. In this challenge paper, we make power usage dataset available from 8 institutions in manufacturing, education and medical institutions from the US and India, and an initial un-supervised machine learning based solution as a baseline for the community to accelerate research in this area.

Predicting the economy's short-term dynamics -- a vital input to economic agents' decision-making process -- often uses lagged indicators in linear models. This is typically sufficient during normal times but could prove inadequate during crisis periods. This paper aims to demonstrate that non-traditional and timely data such as retail and wholesale payments, with the aid of nonlinear machine learning approaches, can provide policymakers with sophisticated models to accurately estimate key macroeconomic indicators in near real-time. Moreover, we provide a set of econometric tools to mitigate overfitting and interpretability challenges in machine learning models to improve their effectiveness for policy use. Our models with payments data, nonlinear methods, and tailored cross-validation approaches help improve macroeconomic nowcasting accuracy up to 40\% -- with higher gains during the COVID-19 period. We observe that the contribution of payments data for economic predictions is small and linear during low and normal growth periods. However, the payments data contribution is large, asymmetrical, and nonlinear during strong negative or positive growth periods.

Standard views in two-dimensional echocardiography are well established but the quality of acquired images are highly dependent on operator skills and are assessed subjectively. This study is aimed at providing an objective assessment pipeline for echocardiogram image quality by defining a new set of domain-specific quality indicators. Consequently, image quality assessment can thus be automated to enhance clinical measurements, interpretation, and real-time optimization. We have developed deep neural networks for the automated assessment of echocardiographic frame which were randomly sampled from 11,262 adult patients. The private echocardiography dataset consists of 33,784 frames, previously acquired between 2010 and 2020. Deep learning approaches were used to extract the spatiotemporal features and the image quality indicators were evaluated against the mean absolute error. Our quality indicators encapsulate both anatomical and pathological elements to provide multivariate assessment scores for anatomical visibility, clarity, depth-gain and foreshortedness, respectively.

Combinatorial optimization problem (COP) over graphs is a fundamental challenge in optimization. Reinforcement learning (RL) has recently emerged as a new framework to tackle these problems and has demonstrated promising results. However, most RL solutions employ a greedy manner to construct the solution incrementally, thus inevitably pose unnecessary dependency on action sequences and need a lot of problem-specific designs. We propose a general RL framework that not only exhibits state-of-the-art empirical performance but also generalizes to a variety class of COPs. Specifically, we define state as a solution to a problem instance and action as a perturbation to this solution. We utilize graph neural networks (GNN) to extract latent representations for given problem instances for state-action encoding, and then apply deep Q-learning to obtain a policy that gradually refines the solution by flipping or swapping vertex labels. Experiments are conducted on Maximum $k$-Cut and Traveling Salesman Problem and performance improvement is achieved against a set of learning-based and heuristic baselines.

Hail risk assessment is necessary to estimate and reduce damage to crops, orchards, and infrastructure. Also, it helps to estimate and reduce consequent losses for businesses and, particularly, insurance companies. But hail forecasting is challenging. Data used for designing models for this purpose are tree-dimensional geospatial time series. Hail is a very local event with respect to the resolution of available datasets. Also, hail events are rare - only 1% of targets in observations are marked as "hail". Models for nowcasting and short-term hail forecasts are improving. Introducing machine learning models to the meteorology field is not new. There are also various climate models reflecting possible scenarios of climate change in the future. But there are no machine learning models for data-driven forecasting of changes in hail frequency for a given area. The first possible approach for the latter task is to ignore spatial and temporal structure and develop a model capable of classifying a given vertical profile of meteorological variables as favorable to hail formation or not. Although such an approach certainly neglects important information, it is very light weighted and easily scalable because it treats observations as independent from each other. The more advanced approach is to design a neural network capable to process geospatial data. Our idea here is to combine convolutional layers responsible for the processing of spatial data with recurrent neural network blocks capable to work with temporal structure. This study compares two approaches and introduces a model suitable for the task of forecasting changes in hail frequency for ongoing decades.

In this work, we introduce a differentially private method for generating synthetic data from vertically partitioned data, \emph{i.e.}, where data of the same individuals is distributed across multiple data holders or parties. We present a differentially privacy stochastic gradient descent (DP-SGD) algorithm to train a mixture model over such partitioned data using variational inference. We modify a secure multiparty computation (MPC) framework to combine MPC with differential privacy (DP), in order to use differentially private MPC effectively to learn a probabilistic generative model under DP on such vertically partitioned data. Assuming the mixture components contain no dependencies across different parties, the objective function can be factorized into a sum of products of the contributions calculated by the parties. Finally, MPC is used to compute the aggregate between the different contributions. Moreover, we rigorously define the privacy guarantees with respect to the different players in the system. To demonstrate the accuracy of our method, we run our algorithm on the Adult dataset from the UCI machine learning repository, where we obtain comparable results to the non-partitioned case.

In this note, we study how neural networks with a single hidden layer and ReLU activation interpolate data drawn from a radially symmetric distribution with target labels 1 at the origin and 0 outside the unit ball, if no labels are known inside the unit ball. With weight decay regularization and in the infinite neuron, infinite data limit, we prove that a unique radially symmetric minimizer exists, whose weight decay regularizer and Lipschitz constant grow as $d$ and $\sqrt{d}$ respectively. We furthermore show that the weight decay regularizer grows exponentially in $d$ if the label $1$ is imposed on a ball of radius $\varepsilon$ rather than just at the origin. By comparison, a neural networks with two hidden layers can approximate the target function without encountering the curse of dimensionality.  ( 2 min )

Speech Neuroprostheses have the potential to enable communication for people with dysarthria or anarthria. Recent advances have demonstrated high-quality text decoding and speech synthesis from electrocorticographic grids placed on the cortical surface. Here, we investigate a less invasive measurement modality in three participants, namely stereotactic EEG (sEEG) that provides sparse sampling from multiple brain regions, including subcortical regions. To evaluate whether sEEG can also be used to synthesize high-quality audio from neural recordings, we employ a recurrent encoder-decoder model based on modern deep learning methods. We find that speech can indeed be reconstructed with correlations up to 0.8 from these minimally invasive recordings, despite limited amounts of training data.  ( 2 min )

In reinforcement learning (RL), the goal is to obtain an optimal policy, for which the optimality criterion is fundamentally important. Two major optimality criteria are average and discounted rewards. While the latter is more popular, it is problematic to apply in environments without an inherent notion of discounting. This motivates us to revisit a) the progression of optimality criteria in dynamic programming, b) justification for and complication of an artificial discount factor, and c) benefits of directly maximizing the average reward criterion, which is discounting-free. Our contributions include a thorough examination of the relationship between average and discounted rewards, as well as a discussion of their pros and cons in RL. We emphasize that average-reward RL methods possess the ingredient and mechanism for applying a family of discounting-free optimality criteria (Veinott, 1969) to RL.  ( 2 min )

Choosing a publication venue for an academic paper is a crucial step in the research process. However, in many cases, decisions are based solely on the experience of researchers, which often leads to suboptimal results. Although there exist venue recommender systems for academic papers, they recommend venues where the paper is expected to be published. In this study, we aim to recommend publication venues from a different perspective. We estimate the number of citations a paper will receive if the paper is published in each venue and recommend the venue where the paper has the most potential impact. However, there are two challenges to this task. First, a paper is published in only one venue, and thus, we cannot observe the number of citations the paper would receive if the paper were published in another venue. Secondly, the contents of a paper and the publication venue are not statistically independent; that is, there exist selection biases in choosing publication venues. In this paper, we formulate the venue recommendation problem as a treatment effect estimation problem. We use a bias correction method to estimate the potential impact of choosing a publication venue effectively and to recommend venues based on the potential impact of papers in each venue. We highlight the effectiveness of our method using paper data from computer science conferences.  ( 3 min )

Graph neural networks (GNNs) have been demonstrated as a powerful tool for analysing non-Euclidean graph data. However, the lack of efficient distributed graph learning (GL) systems severely hinders applications of GNNs, especially when graphs are big and GNNs are relatively deep. Herein, we present GraphTheta, a novel distributed and scalable GL system implemented in vertex-centric graph programming model. GraphTheta is the first GL system built upon distributed graph processing with neural network operators implemented as user-defined functions. This system supports multiple training strategies, and enables efficient and scalable big graph learning on distributed (virtual) machines with low memory each. To facilitate graph convolution implementations, GraphTheta puts forward a new GL abstraction named NN-TGAR to bridge the gap between graph processing and graph deep learning. A distributed graph engine is proposed to conduct the stochastic gradient descent optimization with a hybrid-parallel execution. Moreover, we add support for a new cluster-batched training strategy besides global-batch and mini-batch. We evaluate GraphTheta using a number of datasets with network size ranging from small-, modest- to large-scale. Experimental results show that GraphTheta can scale well to 1,024 workers for training an in-house developed GNN on an industry-scale Alipay dataset of 1.4 billion nodes and 4.1 billion attributed edges, with a cluster of CPU virtual machines (dockers) of small memory each (5$\sim$12GB). Moreover, GraphTheta obtains comparable or better prediction results than the state-of-the-art GNN implementations, demonstrating its capability of learning GNNs as well as existing frameworks, and can outperform DistDGL by up to $2.02\times$ with better scalability. To the best of our knowledge, this work presents the largest edge-attributed GNN learning task conducted in the literature.  ( 3 min )

Graphs are commonly used to represent and visualize causal relations. For a small number of variables, this approach provides a succinct and clear view of the scenario at hand. As the number of variables under study increases, the graphical approach may become impractical, and the clarity of the representation is lost. Clustering of variables is a natural way to reduce the size of the causal diagram, but it may erroneously change the essential properties of the causal relations if implemented arbitrarily. We define a specific type of cluster, called transit cluster, that is guaranteed to preserve the identifiability properties of causal effects under certain conditions. We provide a sound and complete algorithm for finding all transit clusters in a given graph and demonstrate how clustering can simplify the identification of causal effects. We also study the inverse problem, where one starts with a clustered graph and looks for extended graphs where the identifiability properties of causal effects remain unchanged. We show that this kind of structural robustness is closely related to transit clusters.  ( 2 min )

Transfer learning aims to learn classifiers for a target domain by transferring knowledge from a source domain. However, due to two main issues: feature discrepancy and distribution divergence, transfer learning can be a very difficult problem in practice. In this paper, we present a framework called TLF that builds a classifier for the target domain having only few labeled training records by transferring knowledge from the source domain having many labeled records. While existing methods often focus on one issue and leave the other one for the further work, TLF is capable of handling both issues simultaneously. In TLF, we alleviate feature discrepancy by identifying shared label distributions that act as the pivots to bridge the domains. We handle distribution divergence by simultaneously optimizing the structural risk functional, joint distributions between domains, and the manifold consistency underlying marginal distributions. Moreover, for the manifold consistency we exploit its intrinsic properties by identifying k nearest neighbors of a record, where the value of k is determined automatically in TLF. Furthermore, since negative transfer is not desired, we consider only the source records that are belonging to the source pivots during the knowledge transfer. We evaluate TLF on seven publicly available natural datasets and compare the performance of TLF against the performance of fourteen state-of-the-art techniques. We also evaluate the effectiveness of TLF in some challenging situations. Our experimental results, including statistical sign test and Nemenyi test analyses, indicate a clear superiority of the proposed framework over the state-of-the-art techniques.  ( 3 min )

Many NLP tasks benefit from using large language models (LLMs) that often have more than 100 billion parameters. With the release of BLOOM-176B and OPT-175B, everyone can download pretrained models of this scale. Still, using these models requires high-end hardware unavailable to many researchers. In some cases, LLMs can be used more affordably via RAM offloading or hosted APIs. However, these techniques have innate limitations: offloading is too slow for interactive inference, while APIs are not flexible enough for research. In this work, we propose Petals $-$ a system for inference and fine-tuning of large models collaboratively by joining the resources of multiple parties trusted to process client's data. We demonstrate that this strategy significantly outperforms offloading for very large models, running inference of BLOOM-176B on consumer GPUs with $\approx$ 1 step per second. Unlike most inference APIs, Petals also natively exposes the hidden states of served models, allowing its users to train and share custom model extensions based on efficient fine-tuning methods.  ( 2 min )

Reverse engineers benefit from the presence of identifiers such as function names in a binary, but usually these are removed for release. Training a machine learning model to predict function names automatically is promising but fundamentally hard: unlike words in natural language, most function names occur only once. In this paper, we address this problem by introducing eXtreme Function Labeling (XFL), an extreme multi-label learning approach to selecting appropriate labels for binary functions. XFL splits function names into tokens, treating each as an informative label akin to the problem of tagging texts in natural language. We relate the semantics of binary code to labels through DEXTER, a novel function embedding that combines static analysis-based features with local context from the call graph and global context from the entire binary. We demonstrate that XFL/DEXTER outperforms the state of the art in function labeling on a dataset of 10,047 binaries from the Debian project, achieving a precision of 83.5%. We also study combinations of XFL with alternative binary embeddings from the literature and show that DEXTER consistently performs best for this task. As a result, we demonstrate that binary function labeling can be effectively phrased in terms of multi-label learning, and that binary function embeddings benefit from including explicit semantic features.  ( 3 min )

Many modern machine learning applications, such as multi-task learning, require finding optimal model parameters to trade-off multiple objective functions that may conflict with each other. The notion of the Pareto set allows us to focus on the set of (often infinite number of) models that cannot be strictly improved. But it does not provide an actionable procedure for picking one or a few special models to return to practical users. In this paper, we consider \emph{optimization in Pareto set (OPT-in-Pareto)}, the problem of finding Pareto models that optimize an extra reference criterion function within the Pareto set. This function can either encode a specific preference from the users, or represent a generic diversity measure for obtaining a set of diversified Pareto models that are representative of the whole Pareto set. Unfortunately, despite being a highly useful framework, efficient algorithms for OPT-in-Pareto have been largely missing, especially for large-scale, non-convex, and non-linear objectives in deep learning. A naive approach is to apply Riemannian manifold gradient descent on the Pareto set, which yields a high computational cost due to the need for eigen-calculation of Hessian matrices. We propose a first-order algorithm that approximately solves OPT-in-Pareto using only gradient information, with both high practical efficiency and theoretically guaranteed convergence property. Empirically, we demonstrate that our method works efficiently for a variety of challenging multi-task-related problems.  ( 3 min )

With the rise and ever-increasing potential of deep learning techniques in recent years, publicly available medical datasets became a key factor to enable reproducible development of diagnostic algorithms in the medical domain. Medical data contains sensitive patient-related information and is therefore usually anonymized by removing patient identifiers, e.g., patient names before publication. To the best of our knowledge, we are the first to show that a well-trained deep learning system is able to recover the patient identity from chest X-ray data. We demonstrate this using the publicly available large-scale ChestX-ray14 dataset, a collection of 112,120 frontal-view chest X-ray images from 30,805 unique patients. Our verification system is able to identify whether two frontal chest X-ray images are from the same person with an AUC of 0.9940 and a classification accuracy of 95.55%. We further highlight that the proposed system is able to reveal the same person even ten and more years after the initial scan. When pursuing a retrieval approach, we observe an mAP@R of 0.9748 and a precision@1 of 0.9963. Furthermore, we achieve an AUC of up to 0.9870 and a precision@1 of up to 0.9444 when evaluating our trained networks on external datasets such as CheXpert and the COVID-19 Image Data Collection. Based on this high identification rate, a potential attacker may leak patient-related information and additionally cross-reference images to obtain more information. Thus, there is a great risk of sensitive content falling into unauthorized hands or being disseminated against the will of the concerned patients. Especially during the COVID-19 pandemic, numerous chest X-ray datasets have been published to advance research. Therefore, such data may be vulnerable to potential attacks by deep learning-based re-identification algorithms.  ( 3 min )

A support vector machine (SVM) is an algorithm that finds a hyperplane which optimally separates labeled data points in $\mathbb{R}^n$ into positive and negative classes. The data points on the margin of this separating hyperplane are called support vectors. We connect the possible configurations of support vectors to Radon's theorem, which provides guarantees for when a set of points can be divided into two classes (positive and negative) whose convex hulls intersect. If the convex hulls of the positive and negative support vectors are projected onto a separating hyperplane, then the projections intersect if and only if the hyperplane is optimal. Further, with a particular type of general position, we show that (a) the projected convex hulls of the support vectors intersect in exactly one point, (b) the support vectors are stable under perturbation, (c) there are at most $n+1$ support vectors, and (d) every number of support vectors from 2 up to $n+1$ is possible. Finally, we perform computer simulations studying the expected number of support vectors, and their configurations, for randomly generated data. We observe that as the distance between classes of points increases for this type of randomly generated data, configurations with fewer support vectors become more likely.  ( 3 min )

The co-adaptation of robots has been a long-standing research endeavour with the goal of adapting both body and behaviour of a system for a given task, inspired by the natural evolution of animals. Co-adaptation has the potential to eliminate costly manual hardware engineering as well as improve the performance of systems. The standard approach to co-adaptation is to use a reward function for optimizing behaviour and morphology. However, defining and constructing such reward functions is notoriously difficult and often a significant engineering effort. This paper introduces a new viewpoint on the co-adaptation problem, which we call co-imitation: finding a morphology and a policy that allow an imitator to closely match the behaviour of a demonstrator. To this end we propose a co-imitation methodology for adapting behaviour and morphology by matching state distributions of the demonstrator. Specifically, we focus on the challenging scenario with mismatched state- and action-spaces between both agents. We find that co-imitation increases behaviour similarity across a variety of tasks and settings, and demonstrate co-imitation by transferring human walking, jogging and kicking skills onto a simulated humanoid.  ( 2 min )

We propose a family of First Hitting Diffusion Models (FHDM), deep generative models that generate data with a diffusion process that terminates at a random first hitting time. This yields an extension of the standard fixed-time diffusion models that terminate at a pre-specified deterministic time. Although standard diffusion models are designed for continuous unconstrained data, FHDM is naturally designed to learn distributions on continuous as well as a range of discrete and structure domains. Moreover, FHDM enables instance-dependent terminate time and accelerates the diffusion process to sample higher quality data with fewer diffusion steps. Technically, we train FHDM by maximum likelihood estimation on diffusion trajectories augmented from observed data with conditional first hitting processes (i.e., bridge) derived based on Doob's $h$-transform, deviating from the commonly used time-reversal mechanism. We apply FHDM to generate data in various domains such as point cloud (general continuous distribution), climate and geographical events on earth (continuous distribution on the sphere), unweighted graphs (distribution of binary matrices), and segmentation maps of 2D images (high-dimensional categorical distribution). We observe considerable improvement compared with the state-of-the-art approaches in both quality and speed.  ( 2 min )

Graph Neural Networks (GNNs) have received much attention in the graph deep learning domain. However, recent research empirically and theoretically shows that deep GNNs suffer from over-fitting and over-smoothing problems. The usual solutions either cannot solve extensive runtime of deep GNNs or restrict graph convolution in the same feature space. We propose the Adaptive Graph Diffusion Networks (AGDNs) which perform multi-layer generalized graph diffusion in different feature spaces with moderate complexity and runtime. Standard graph diffusion methods combine large and dense powers of the transition matrix with predefined weighting coefficients. Instead, AGDNs combine smaller multi-hop node representations with learnable and generalized weighting coefficients. We propose two scalable mechanisms of weighting coefficients to capture multi-hop information: Hop-wise Attention (HA) and Hop-wise Convolution (HC). We evaluate AGDNs on diverse, challenging Open Graph Benchmark (OGB) datasets with semi-supervised node classification and link prediction tasks. Until the date of submission (Aug 26, 2022), AGDNs achieve top-1 performance on the ogbn-arxiv, ogbn-proteins and ogbl-ddi datasets and top-3 performance on the ogbl-citation2 dataset. On the similar Tesla V100 GPU cards, AGDNs outperform Reversible GNNs (RevGNNs) with 13% complexity and 1% training runtime of RevGNNs on the ogbn-proteins dataset. AGDNs also achieve comparable performance to SEAL with 36% training and 0.2% inference runtime of SEAL on the ogbl-citation2 dataset.  ( 3 min )

Despite the fundamental distinction between adversarial and natural training (AT and NT), AT methods generally adopt momentum SGD (MSGD) for the outer optimization. This paper aims to analyze this choice by investigating the overlooked role of outer optimization in AT. Our exploratory evaluations reveal that AT induces higher gradient norm and variance compared to NT. This phenomenon hinders the outer optimization in AT since the convergence rate of MSGD is highly dependent on the variance of the gradients. To this end, we propose an optimization method called ENGM which regularizes the contribution of each input example to the average mini-batch gradients. We prove that the convergence rate of ENGM is independent of the variance of the gradients, and thus, it is suitable for AT. We introduce a trick to reduce the computational cost of ENGM using empirical observations on the correlation between the norm of gradients w.r.t. the network parameters and input examples. Our extensive evaluations and ablation studies on CIFAR-10, CIFAR-100, and TinyImageNet demonstrate that ENGM and its variants consistently improve the performance of a wide range of AT methods. Furthermore, ENGM alleviates major shortcomings of AT including robust overfitting and high sensitivity to hyperparameter settings.  ( 2 min )

Knowledge graphs (KGs) are known for their large scale and knowledge inference ability, but are also notorious for the incompleteness associated with them. Due to the long-tail distribution of the relations in KGs, few-shot KG completion has been proposed as a solution to alleviate incompleteness and expand the coverage of KGs. It aims to make predictions for triplets involving novel relations when only a few training triplets are provided as reference. Previous methods have mostly focused on designing local neighbor aggregators to learn entity-level information and/or imposing sequential dependency assumption at the triplet level to learn meta relation information. However, valuable pairwise triplet-level interactions and context-level relational information have been largely overlooked for learning meta representations of few-shot relations. In this paper, we propose a hierarchical relational learning method (HiRe) for few-shot KG completion. By jointly capturing three levels of relational information (entity-level, triplet-level and context-level), HiRe can effectively learn and refine the meta representation of few-shot relations, and consequently generalize very well to new unseen relations. Extensive experiments on two benchmark datasets validate the superiority of HiRe against other state-of-the-art methods.  ( 2 min )

Prediction of correlation matrices from given time series data has several applications for a range of problems, such as inferring neuronal connections from spiking data, deducing causal dependencies between genes from expression data, and discovering long spatial range influences in climate variations. Traditional methods of predicting correlation matrices utilize time series data of all the nodes of the underlying networks. Here, we use a supervised machine learning technique to predict the correlation matrix of entire systems from finite time series information of a few randomly selected nodes. The accuracy of the prediction from the model confirms that only a limited time series of a subset of the entire system is enough to make good correlation matrix predictions. Furthermore, using an unsupervised learning algorithm, we provide insights into the success of the predictions from our model. Finally, we apply the machine learning model developed here to real-world data sets.  ( 2 min )

The existence of simple, uncoupled no-regret dynamics that converge to correlated equilibria in normal-form games is a celebrated result in the theory of multi-agent systems. Specifically, it has been known for more than 20 years that when all players seek to minimize their internal regret in a repeated normal-form game, the empirical frequency of play converges to a normal-form correlated equilibrium. Extensive-form (that is, tree-form) games generalize normal-form games by modeling both sequential and simultaneous moves, as well as private information. Because of the sequential nature and presence of partial information in the game, extensive-form correlation has significantly different properties than the normal-form counterpart, many of which are still open research directions. Extensive-form correlated equilibrium (EFCE) has been proposed as the natural extensive-form counterpart to normal-form correlated equilibrium. However, it was currently unknown whether EFCE emerges as the result of uncoupled agent dynamics. In this paper, we give the first uncoupled no-regret dynamics that converge to the set of EFCEs in $n$-player general-sum extensive-form games with perfect recall. First, we introduce a notion of trigger regret in extensive-form games, which extends that of internal regret in normal-form games. When each player has low trigger regret, the empirical frequency of play is close to an EFCE. Then, we give an efficient no-trigger-regret algorithm. Our algorithm decomposes trigger regret into local subproblems at each decision point for the player, and constructs a global strategy of the player from the local solutions at each decision point.  ( 3 min )

This study explores the association between music preferences and moral values by applying text analysis techniques to lyrics. Harvesting data from a Facebook-hosted application, we align psychometric scores of 1,386 users to lyrics from the top 5 songs of their preferred music artists as emerged from Facebook Page Likes. We extract a set of lyrical features related to each song's overarching narrative, moral valence, sentiment, and emotion. A machine learning framework was designed to exploit regression approaches and evaluate the predictive power of lyrical features for inferring moral values. Results suggest that lyrics from top songs of artists people like inform their morality. Virtues of hierarchy and tradition achieve higher prediction scores ($.20 \leq r \leq .30$) than values of empathy and equality ($.08 \leq r \leq .11$), while basic demographic variables only account for a small part in the models' explainability. This shows the importance of music listening behaviours, as assessed via lyrical preferences, alone in capturing moral values. We discuss the technological and musicological implications and possible future improvements.  ( 2 min )

In this paper, we derive a novel method as a generalization over LCEs such as E2C. The method develops the idea of learning a locally linear state space, by adding a multi-step prediction, thus allowing for more explicit control over the curvature. We show, that the method outperforms E2C without drastic model changes which come with other works, such as PCC and P3C. We discuss the relation between E2C and the presented method and derived update equations. We provide empirical evidence, which suggests that by considering the multi-step prediction our method - ms-E2C - allows to learn much better latent state spaces in terms of curvature and next state predictability. Finally, we also discuss certain stability challenges we encounter with multi-step predictions and the ways to mitigate them.

Electrocardiogram (ECG) is the most frequent and routine diagnostic tool used for monitoring heart electrical signals and evaluating its functionality. The human heart can suffer from a variety of diseases, including cardiac arrhythmias. Arrhythmia is an irregular heart rhythm that in severe cases can lead to heart stroke and can be diagnosed via ECG recordings. Since early detection of cardiac arrhythmias is of great importance, computerized and automated classification and identification of these abnormal heart signals have received much attention for the past decades. Methods: This paper introduces a light deep learning approach for high accuracy detection of 8 different cardiac arrhythmias and normal rhythm. To leverage deep learning method, resampling and baseline wander removal techniques are applied to ECG signals. In this study, 500 sample ECG segments were used as model inputs. The rhythm classification was done by an 11-layer network in an end-to-end manner without the need for hand-crafted manual feature extraction. Results: In order to evaluate the proposed technique, ECG signals are chosen from the two physionet databases, the MIT-BIH arrhythmia database and the long-term AF database. The proposed deep learning framework based on the combination of Convolutional Neural Network(CNN) and Long Short Term Memory (LSTM) showed promising results than most of the state-of-the-art methods. The proposed method reaches the mean diagnostic accuracy of 98.24%. Conclusion: A trained model for arrhythmia classification using diverse ECG signals were successfully developed and tested. Significance: Since the present work uses a light classification technique with high diagnostic accuracy compared to other notable methods, it could successfully be implemented in holter monitor devices for arrhythmia detection.

End-to-end deep trainable models are about to exceed the performance of the traditional handcrafted compression techniques on videos and images. The core idea is to learn a non-linear transformation, modeled as a deep neural network, mapping input image into latent space, jointly with an entropy model of the latent distribution. The decoder is also learned as a deep trainable network, and the reconstructed image measures the distortion. These methods enforce the latent to follow some prior distributions. Since these priors are learned by optimization over the entire training set, the performance is optimal in average. However, it cannot fit exactly on every single new instance, hence damaging the compression performance by enlarging the bit-stream. In this paper, we propose a simple yet efficient instance-based parameterization method to reduce this amortization gap at a minor cost. The proposed method is applicable to any end-to-end compressing methods, improving the compression bitrate by 1% without any impact on the reconstruction quality.

The classification of electroencephalography (EEG) signals is useful in a wide range of applications such as seizure detection/prediction, motor imagery classification, emotion classification and drug effects diagnosis, amongst others. With the large number of EEG channels acquired, it has become vital that efficient data-reduction methods are developed, with varying importance from one application to another. It is also important that online classification is achieved during EEG recording for many applications, to monitor changes as they happen. In this paper we introduce a method based on Mutual Information (MI), for channel selection. Obtained results show that whilst there is a penalty on classification accuracy scores, promising speed-up gains can be achieved using MI techniques. Using MI with signal epochs (3secs) containing signal transitions enhances these speed-up gains. This work is exploratory and we suggest further research to be carried out for validation and development. Benefits to improving classification speed include improving application in clinical or educational settings.  ( 2 min )

In this paper, we propose SATformer, a novel Transformer-based solution for Boolean satisfiability (SAT) solving. Different from existing learning-based SAT solvers that learn at the problem instance level, SATformer learns the minimum unsatisfiable cores (MUC) of unsatisfiable problem instances, which provide rich information for the causality of such problems. Specifically, we apply a graph neural network (GNN) to obtain the embeddings of the clauses in the conjunctive normal format (CNF). A hierarchical Transformer architecture is applied on the clause embeddings to capture the relationships among clauses, and the self-attention weight is learned to be high when those clauses forming UNSAT cores are attended together, and set to be low otherwise. By doing so, SATformer effectively learns the correlations among clauses for SAT prediction. Experimental results show that SATformer is more powerful than existing end-to-end learning-based SAT solvers.  ( 2 min )

Recent advances in machine learning showed that pre-training representations acquired via self-supervised learning could achieve high accuracy on tasks with small training data. Unlike in vision and natural language processing domains, such pre-training for IMU-based applications is challenging, as there are only a few publicly available datasets with sufficient size and diversity to learn generalizable representations. To overcome this problem, we propose IMG2IMU, a novel approach that adapts pre-train representation from large-scale images to diverse few-shot IMU sensing tasks. We convert the sensor data into visually interpretable spectrograms for the model to utilize the knowledge gained from vision. Further, we apply contrastive learning on an augmentation set we designed to learn representations that are tailored to interpreting sensor data. Our extensive evaluations on five different IMU sensing tasks show that IMG2IMU consistently outperforms the baselines, illustrating that vision knowledge can be incorporated into a few-shot learning environment for IMU sensing tasks.  ( 2 min )

Graph Neural Networks (GNNs) are widely used for graph representation learning. Despite its prevalence, GNN suffers from two drawbacks in the graph classification task, the neglect of graph-level relationships, and the generalization issue. Each graph is treated separately in GNN message passing/graph pooling, and existing methods to address overfitting operate on each individual graph. This makes the graph representations learnt less effective in the downstream classification. In this paper, we propose a Class-Aware Representation rEfinement (CARE) framework for the task of graph classification. CARE computes simple yet powerful class representations and injects them to steer the learning of graph representations towards better class separability. CARE is a plug-and-play framework that is highly flexible and able to incorporate arbitrary GNN backbones without significantly increasing the computational cost. We also theoretically prove that CARE has a better generalization upper bound than its GNN backbone through Vapnik-Chervonenkis (VC) dimension analysis. Our extensive experiments with 10 well-known GNN backbones on 9 benchmark datasets validate the superiority and effectiveness of CARE over its GNN counterparts.  ( 2 min )

Command and Control (C2) communication is a key component of any structured cyber-attack. As such, security operations actively try to detect this type of communication in their networks. This poses a problem for legitimate pentesters that try to remain undetected, since commonly used pentesting tools, such as Metasploit, generate constant traffic patterns that are easily distinguishable from regular web traffic. In this paper we start with these identifiable patterns in Metasploit's C2 traffic and show that a machine learning-based detector is able to detect the presence of such traffic with high accuracy, even when encrypted. We then outline and implement a set of modifications to the Metasploit framework in order to decrease the detection rates of such classifier. To evaluate the performance of these modifications, we use two threat models with increasing awareness of these modifications. We look at the detection evasion performance and at the byte count and runtime overhead of the modifications. Our results show that for the second, increased-awareness threat model the framework-side traffic modifications yield a better detection avoidance rate (90%) than payload-side only modifications (50%). We also show that although the modifications use up to 3 times more TLS payload bytes than the original, the runtime does not significantly change and the total number of bytes (including TLS payload) reduces.  ( 3 min )

In this paper, we propose to leverage the unique characteristics of dialogues sharing commonsense knowledge across participants, to resolve the difficulties in summarizing them. We present SICK, a framework that uses commonsense inferences as additional context. Compared to previous work that solely relies on the input dialogue, SICK uses an external knowledge model to generate a rich set of commonsense inferences and selects the most probable one with a similarity-based selection method. Built upon SICK, SICK++ utilizes commonsense as supervision, where the task of generating commonsense inferences is added upon summarizing the dialogue in a multi-task learning setting. Experimental results show that with injected commonsense knowledge, our framework generates more informative and consistent summaries than existing methods.  ( 2 min )

In this work, we explore recurrent neural network architectures for tuberculosis (TB) cough classification. In contrast to previous unsuccessful attempts to implement deep architectures in this domain, we show that a basic bidirectional long short-term memory network (BiLSTM) can achieve improved performance. In addition, we show that by performing greedy feature selection in conjunction with a newly-proposed attention-based architecture that learns patient invariant features, substantially better generalisation can be achieved compared to a baseline and other considered architectures. Furthermore, this attention mechanism allows an inspection of the temporal regions of the audio signal considered to be important for classification to be performed. Finally, we develop a neural style transfer technique to infer idealised inputs which can subsequently be analysed. We find distinct differences between the idealised power spectra of TB and non-TB coughs, which provide clues about the origin of the features in the audio signal.  ( 2 min )

Removing the influence of a specified subset of training data from a machine learning model may be required to address issues such as privacy, fairness, and data quality. Retraining the model from scratch on the remaining data after removal of the subset is an effective but often infeasible option, due to its computational expense. The past few years have therefore seen several novel approaches towards efficient removal, forming the field of "machine unlearning", however, many aspects of the literature published thus far are disparate and lack consensus. In this paper, we summarise and compare seven state-of-the-art machine unlearning algorithms, consolidate definitions of core concepts used in the field, reconcile different approaches for evaluating algorithms, and discuss issues related to applying machine unlearning in practice.  ( 2 min )

Multi-modal entity alignment aims to identify equivalent entities between two different multi-modal knowledge graphs, which consist of structural triples and images associated with entities. Most previous works focus on how to utilize and encode information from different modalities, while it is not trivial to leverage multi-modal knowledge in entity alignment because of the modality heterogeneity. In this paper, we propose MCLEA, a Multi-modal Contrastive Learning based Entity Alignment model, to obtain effective joint representations for multi-modal entity alignment. Different from previous works, MCLEA considers task-oriented modality and models the inter-modal relationships for each entity representation. In particular, MCLEA firstly learns multiple individual representations from multiple modalities, and then performs contrastive learning to jointly model intra-modal and inter-modal interactions. Extensive experimental results show that MCLEA outperforms state-of-the-art baselines on public datasets under both supervised and unsupervised settings.  ( 2 min )

While representation learning has been central to the rise of machine learning and artificial intelligence, a key problem remains in making the learnt representations meaningful. For this the typical approach is to regularize the learned representation through prior probability distributions. However such priors are usually unavailable or ad hoc. To deal with this, we propose a dynamics-constrained representation learning framework. Instead of using predefined probabilities, we restrict the latent representation to follow specific dynamics, which is a more natural constraint for representation learning in dynamical systems. Our belief stems from a fundamental observation in physics that though different systems can have different marginalized probability distributions, they typically obey the same dynamics, such as Newton's and Schrodinger's equations. We validate our framework for different systems including a real-world fluorescent DNA movie dataset. We show that our algorithm can uniquely identify an uncorrelated, isometric and meaningful latent representation.  ( 3 min )

Bayesian optimization is a popular formalism for global optimization, but its computational costs limit it to expensive-to-evaluate functions. A competing, computationally more efficient, global optimization framework is optimistic optimization, which exploits prior knowledge about the geometry of the search space in form of a dissimilarity function. We investigate to which degree the conceptual advantages of Bayesian Optimization can be combined with the computational efficiency of optimistic optimization. By mapping the kernel to a dissimilarity, we obtain an optimistic optimization algorithm for the Bayesian Optimization setting with a run-time of up to $\mathcal{O}(N \log N)$. As a high-level take-away we find that, when using stationary kernels on objectives of relatively low evaluation cost, optimistic optimization can be strongly preferable over Bayesian optimization, while for strongly coupled and parametric models, good implementations of Bayesian optimization can perform much better, even at low evaluation cost. We argue that there is a new research domain between geometric and probabilistic search, i.e. methods that run drastically faster than traditional Bayesian optimization, while retaining some of the crucial functionality of Bayesian optimization.  ( 2 min )

Longitudinal imaging is able to capture both static anatomical structures and dynamic changes in disease progression towards earlier and better patient-specific pathology management. However, conventional approaches for detecting diabetic retinopathy (DR) rarely take advantage of longitudinal information to improve DR analysis. In this work, we investigate the benefit of exploiting self-supervised learning with a longitudinal nature for DR diagnosis purposes. We compare different longitudinal self-supervised learning (LSSL) methods to model the disease progression from longitudinal retinal color fundus photographs (CFP) to detect early DR severity changes using a pair of consecutive exams. The experiments were conducted on a longitudinal DR screening dataset with or without those trained encoders (LSSL) acting as a longitudinal pretext task. Results achieve an AUC of 0.875 for the baseline (model trained from scratch) and an AUC of 0.96 (95% CI: 0.9593-0.9655 DeLong test) with a p-value < 2.2e-16 on early fusion using a simple ResNet alike architecture with frozen LSSL weights, suggesting that the LSSL latent space enables to encode the dynamic of DR progression.  ( 2 min )

Noisy labels are unavoidable yet troublesome in the ecosystem of deep learning because models can easily overfit them. There are many types of label noise, such as symmetric, asymmetric and instance-dependent noise (IDN), with IDN being the only type that depends on image information. Such dependence on image information makes IDN a critical type of label noise to study, given that labelling mistakes are caused in large part by insufficient or ambiguous information about the visual classes present in images. Aiming to provide an effective technique to address IDN, we present a new graphical modelling approach called InstanceGM, that combines discriminative and generative models. The main contributions of InstanceGM are: i) the use of the continuous Bernoulli distribution to train the generative model, offering significant training advantages, and ii) the exploration of a state-of-the-art noisy-label discriminative classifier to generate clean labels from instance-dependent noisy-label samples. InstanceGM is competitive with current noisy-label learning approaches, particularly in IDN benchmarks using synthetic and real-world datasets, where our method shows better accuracy than the competitors in most experiments.  ( 2 min )

Indirect discrimination is an issue of major concern in algorithmic models. This is particularly the case in insurance pricing where protected policyholder characteristics are not allowed to be used for insurance pricing. Simply disregarding protected policyholder information is not an appropriate solution because this still allows for the possibility of inferring the protected characteristics from the non-protected ones. This leads to so-called proxy or indirect discrimination. Though proxy discrimination is qualitatively different from the group fairness concepts in machine learning, these group fairness concepts are proposed to 'smooth out' the impact of protected characteristics in the calculation of insurance prices. The purpose of this note is to share some thoughts about group fairness concepts in the light of insurance pricing and to discuss their implications. We present a statistical model that is free of proxy discrimination, thus, unproblematic from an insurance pricing point of view. However, we find that the canonical price in this statistical model does not satisfy any of the three most popular group fairness axioms. This seems puzzling and we welcome feedback on our example and on the usefulness of these group fairness axioms for non-discriminatory insurance pricing.  ( 2 min )

Front-end electronics equipped with high-speed digitizers are being used and proposed for future nuclear detectors. Recent literature reveals that deep learning models, especially one-dimensional convolutional neural networks, are promising when dealing with digital signals from nuclear detectors. Simulations and experiments demonstrate the satisfactory accuracy and additional benefits of neural networks in this area. However, specific hardware accelerating such models for online operations still needs to be studied. In this work, we introduce PulseDL-II, a system-on-chip (SoC) specially designed for applications of event feature (time, energy, etc.) extraction from pulses with deep learning. Based on the previous version, PulseDL-II incorporates a RISC CPU into the system structure for better functional flexibility and integrity. The neural network accelerator in the SoC adopts a three-level (arithmetic unit, processing element, neural network) hierarchical architecture and facilitates parameter optimization of the digital design. Furthermore, we devise a quantization scheme and associated implementation methods (rescale & bit-shift) for full compatibility with deep learning frameworks (e.g., TensorFlow) within a selected subset of layer types. With the current scheme, the quantization-aware training of neural networks is supported, and network models are automatically transformed into software of RISC CPU by dedicated scripts, with nearly no loss of accuracy. We validate PulseDL-II on field programmable gate arrays (FPGA). Finally, system validation is done with an experimental setup made up of a direct digital synthesis (DDS) signal generator and an FPGA development board with analog-to-digital converters (ADC). The proposed system achieved 60 ps time resolution and 0.40% energy resolution with online neural network inference at signal to noise ratio (SNR) of 47.4 dB.  ( 3 min )

We analyze the cumulative regret of the Dyadic Search algorithm of Bachoc et al. [2022].  ( 2 min )

Restricted Boltzmann Machines (RBMs) offer a versatile architecture for unsupervised machine learning that can in principle approximate any target probability distribution with arbitrary accuracy. However, the RBM model is usually not directly accessible due to its computational complexity, and Markov-chain sampling is invoked to analyze the learned probability distribution. For training and eventual applications, it is thus desirable to have a sampler that is both accurate and efficient. We highlight that these two goals generally compete with each other and cannot be achieved simultaneously. More specifically, we identify and quantitatively characterize three regimes of RBM learning: independent learning, where the accuracy improves without losing efficiency; correlation learning, where higher accuracy entails lower efficiency; and degradation, where both accuracy and efficiency no longer improve or even deteriorate. These findings are based on numerical experiments and heuristic arguments.  ( 2 min )

AI-based molecule generation provides a promising approach to a large area of biomedical sciences and engineering, such as antibody design, hydrolase engineering, or vaccine development. Because the molecules are governed by physical laws, a key challenge is to incorporate prior information into the training procedure to generate high-quality and realistic molecules. We propose a simple and novel approach to steer the training of diffusion-based generative models with physical and statistics prior information. This is achieved by constructing physically informed diffusion bridges, stochastic processes that guarantee to yield a given observation at the fixed terminal time. We develop a Lyapunov function based method to construct and determine bridges, and propose a number of proposals of informative prior bridges for both high-quality molecule generation and uniformity-promoted 3D point cloud generation. With comprehensive experiments, we show that our method provides a powerful approach to the 3D generation task, yielding molecule structures with better quality and stability scores and more uniformly distributed point clouds of high qualities.  ( 2 min )

Diffusion models are a class of deep generative models that have shown impressive results on various tasks with dense theoretical founding. Although diffusion models have achieved impressive quality and diversity of sample synthesis than other state-of-the-art models, they still suffer from costly sampling procedure and sub-optimal likelihood estimation. Recent studies have shown great enthusiasm on improving the performance of diffusion model. In this article, we present a first comprehensive review of existing variants of the diffusion models. Specifically, we provide a first taxonomy of diffusion models and categorize them variants to three types, namely sampling-acceleration enhancement, likelihood-maximization enhancement and data-generalization enhancement. We also introduce in detail other five generative models (i.e., variational autoencoders, generative adversarial networks, normalizing flow, autoregressive models, and energy-based models), and clarify the connections between diffusion models and these generative models. Then we make a thorough investigation into the applications of diffusion models, including computer vision, natural language processing, waveform signal processing, multi-modal modeling, molecular graph generation, time series modeling, and adversarial purification. Furthermore, we propose new perspectives pertaining to the development of this generative model.  ( 2 min )

Human Activity Recognition (HAR) based on inertial data is an increasingly diffused task on embedded devices, from smartphones to ultra low-power sensors. Due to the high computational complexity of deep learning models, most embedded HAR systems are based on simple and not-so-accurate classic machine learning algorithms. This work bridges the gap between on-device HAR and deep learning, proposing a set of efficient one-dimensional Convolutional Neural Networks (CNNs) deployable on general purpose microcontrollers (MCUs). Our CNNs are obtained combining hyper-parameters optimization with sub-byte and mixed-precision quantization, to find good trade-offs between classification results and memory occupation. Moreover, we also leverage adaptive inference as an orthogonal optimization to tune the inference complexity at runtime based on the processed input, hence producing a more flexible HAR system. With experiments on four datasets, and targeting an ultra-low-power RISC-V MCU, we show that (i) We are able to obtain a rich set of Pareto-optimal CNNs for HAR, spanning more than 1 order of magnitude in terms of memory, latency and energy consumption; (ii) Thanks to adaptive inference, we can derive >20 runtime operating modes starting from a single CNN, differing by up to 10% in classification scores and by more than 3x in inference complexity, with a limited memory overhead; (iii) on three of the four benchmarks, we outperform all previous deep learning methods, reducing the memory occupation by more than 100x. The few methods that obtain better performance (both shallow and deep) are not compatible with MCU deployment. (iv) All our CNNs are compatible with real-time on-device HAR with an inference latency <16ms. Their memory occupation varies in 0.05-23.17 kB, and their energy consumption in 0.005 and 61.59 uJ, allowing years of continuous operation on a small battery supply.  ( 3 min )

Large-scale graphs are ubiquitous in real-world scenarios and can be trained by Graph Neural Networks (GNNs) to generate representation for downstream tasks. Given the abundant information and complex topology of a large-scale graph, we argue that redundancy exists in such graphs and will degrade the training efficiency. Unfortunately, the model scalability severely restricts the efficiency of training large-scale graphs via vanilla GNNs. Despite recent advances in sampling-based training methods, sampling-based GNNs generally overlook the redundancy issue. It still takes intolerable time to train these models on large-scale graphs. Thereby, we propose to drop redundancy and improve efficiency of training large-scale graphs with GNNs, by rethinking the inherent characteristics in a graph. In this paper, we pioneer to propose a once-for-all method, termed DropReef, to drop the redundancy in large-scale graphs. Specifically, we first conduct preliminary experiments to explore potential redundancy in large-scale graphs. Next, we present a metric to quantify the neighbor heterophily of all nodes in a graph. Based on both experimental and theoretical analysis, we reveal the redundancy in a large-scale graph, i.e., nodes with high neighbor heterophily and a great number of neighbors. Then, we propose DropReef to detect and drop the redundancy in large-scale graphs once and for all, helping reduce the training time while ensuring no sacrifice in the model accuracy. To demonstrate the effectiveness of DropReef, we apply it to recent state-of-the-art sampling-based GNNs for training large-scale graphs, owing to the high precision of such models. With DropReef leveraged, the training efficiency of models can be greatly promoted. DropReef is highly compatible and is offline performed, benefiting the state-of-the-art sampling-based GNNs in the present and future to a significant extent.  ( 3 min )

Temporal graph neural networks (TGNNs) have been widely used for modeling time-evolving graph-related tasks due to their ability to capture both graph topology dependency and non-linear temporal dynamic. The explanation of TGNNs is of vital importance for a transparent and trustworthy model. However, the complex topology structure and temporal dependency make explaining TGNN models very challenging. In this paper, we propose a novel explainer framework for TGNN models. Given a time series on a graph to be explained, the framework can identify dominant explanations in the form of a probabilistic graphical model in a time period. Case studies on the transportation domain demonstrate that the proposed approach can discover dynamic dependency structures in a road network for a time period.  ( 2 min )

Object Rearrangement is to move objects from an initial state to a goal state. Here, we focus on a more practical setting in object rearrangement, i.e., rearranging objects from shuffled layouts to a normative target distribution without explicit goal specification. However, it remains challenging for AI agents, as it is hard to describe the target distribution (goal specification) for reward engineering or collect expert trajectories as demonstrations. Hence, it is infeasible to directly employ reinforcement learning or imitation learning algorithms to address the task. This paper aims to search for a policy only with a set of examples from a target distribution instead of a handcrafted reward function. We employ the score-matching objective to train a Target Gradient Field (TarGF), indicating a direction on each object to increase the likelihood of the target distribution. For object rearrangement, the TarGF can be used in two ways: 1) For model-based planning, we can cast the target gradient into a reference control and output actions with a distributed path planner; 2) For model-free reinforcement learning, the TarGF is not only used for estimating the likelihood-change as a reward but also provides suggested actions in residual policy learning. Experimental results in ball rearrangement and room rearrangement demonstrate that our method significantly outperforms the state-of-the-art methods in the quality of the terminal state, the efficiency of the control process, and scalability. The code and demo videos are on our project website.  ( 3 min )

Preconditioning has been a staple technique in optimization and machine learning. It often reduces the condition number of the matrix it is applied to, thereby speeding up convergence of optimization algorithms. Although there are many popular preconditioning techniques in practice, most lack theoretical guarantees for reductions in condition number. In this paper, we study the problem of optimal diagonal preconditioning to achieve maximal reduction in the condition number of any full-rank matrix by scaling its rows or columns separately or simultaneously. We first reformulate the problem as a quasi-convex problem and provide a baseline bisection algorithm that is easy to implement in practice, where each iteration consists of an SDP feasibility problem. Then we propose a polynomial time potential reduction algorithm with $O(\log(\frac{1}{\epsilon}))$ iteration complexity, where each iteration consists of a Newton update based on the Nesterov-Todd direction. Our algorithm is based on a formulation of the problem which is a generalized version of the Von Neumann optimal growth problem. Next, we specialize to one-sided optimal diagonal preconditioning problems, and demonstrate that they can be formulated as standard dual SDP problems, to which we apply efficient customized solvers and study the empirical performance of our optimal diagonal preconditioners. Our extensive experiments on large matrices demonstrate the practical appeal of optimal diagonal preconditioners at reducing condition numbers compared to heuristics-based preconditioners.  ( 3 min )

Natural language processing (NLP) algorithms are rapidly improving but often struggle when applied to out-of-distribution examples. A prominent approach to mitigate the domain gap is domain adaptation, where a model trained on a source domain is adapted to a new target domain. We present a new learning setup, ``domain adaptation from scratch'', which we believe to be crucial for extending the reach of NLP to sensitive domains in a privacy-preserving manner. In this setup, we aim to efficiently annotate data from a set of source domains such that the trained model performs well on a sensitive target domain from which data is unavailable for annotation. Our study compares several approaches for this challenging setup, ranging from data selection and domain adaptation algorithms to active learning paradigms, on two NLP tasks: sentiment analysis and Named Entity Recognition. Our results suggest that using the abovementioned approaches eases the domain gap, and combining them further improves the results.  ( 2 min )

Typo-squatting domains are a common cyber-attack technique. It involves utilising domain names, that exploit possible typographical errors of commonly visited domains, to carry out malicious activities such as phishing, malware installation, etc. Current approaches typically revolve around string comparison algorithms like the Demaru-Levenschtein Distance (DLD) algorithm. Such techniques do not take into account keyboard distance, which researchers find to have a strong correlation with typical typographical errors and are trying to take account of. In this paper, we present the TypoSwype framework which converts strings to images that take into account keyboard location innately. We also show how modern state of the art image recognition techniques involving Convolutional Neural Networks, trained via either Triplet Loss or NT-Xent Loss, can be applied to learn a mapping to a lower dimensional space where distances correspond to image, and equivalently, textual similarity. Finally, we also demonstrate our method's ability to improve typo-squatting detection over the widely used DLD algorithm, while maintaining the classification accuracy as to which domain the input domain was attempting to typo-squat.  ( 2 min )

Federated learning refers to the task of performing machine learning with decentralized data from multiple clients while protecting data security and privacy. Works have been done to incorporate quantum advantage in such scenarios. However, when the clients' data are not independent and identically distributed (IID), the performance of conventional federated algorithms deteriorates. In this work, we explore this phenomenon in the quantum regime with both theoretical and numerical analysis. We further prove that a global quantum channel can be exactly decomposed into channels trained by each client with the help of local density estimators. It leads to a general framework for quantum federated learning on non-IID data with one-shot communication complexity. We demonstrate it on classification tasks with numerical simulations.  ( 2 min )

Rapid digitalisation spurred by the Covid-19 pandemic has resulted in more cyber crime. Malware-as-a-service is now a booming business for cyber criminals. With the surge in malware activities, it is vital for cyber defenders to understand more about the malware samples they have at hand as such information can greatly influence their next course of actions during a breach. Recently, researchers have shown how malware family classification can be done by first converting malware binaries into grayscale images and then passing them through neural networks for classification. However, most work focus on studying the impact of different neural network architectures on classification performance. In the last year, researchers have shown that augmenting supervised learning with self-supervised learning can improve performance. Even more recently, Data2Vec was proposed as a modality agnostic self-supervised framework to train neural networks. In this paper, we present BinImg2Vec, a framework of training malware binary image classifiers that incorporates both self-supervised learning and supervised learning to produce a model that consistently outperforms one trained only via supervised learning. We were able to achieve a 4% improvement in classification performance and a 0.5% reduction in performance variance over multiple runs. We also show how our framework produces embeddings that can be well clustered, facilitating model explanability.  ( 3 min )

Though graph representation learning (GRL) has made significant progress, it is still a challenge to extract and embed the rich topological structure and feature information in an adequate way. Most existing methods focus on local structure and fail to fully incorporate the global topological structure. To this end, we propose a novel Structure-Preserving Graph Representation Learning (SPGRL) method, to fully capture the structure information of graphs. Specifically, to reduce the uncertainty and misinformation of the original graph, we construct a feature graph as a complementary view via k-Nearest Neighbor method. The feature graph can be used to contrast at node-level to capture the local relation. Besides, we retain the global topological structure information by maximizing the mutual information (MI) of the whole graph and feature embeddings, which is theoretically reduced to exchanging the feature embeddings of the feature and the original graphs to reconstruct themselves. Extensive experiments show that our method has quite superior performance on semi-supervised node classification task and excellent robustness under noise perturbation on graph structure or node features.  ( 2 min )

A significant number of equity funds are preferred by index funds nowadays, and market sensitivities are instrumental in managing them. Index funds might replicate the index identically, which is, however, cost-ineffective and impractical. Moreover, to utilize market sensitivities to replicate the index partially, they must be predicted or estimated accurately. Accordingly, first, we examine deep learning models to predict market sensitivities. Also, we present pragmatic applications of data processing methods to aid training and generate target data for the prediction. Then, we propose a partial-index-tracking optimization model controlling the net predicted market sensitivities of the portfolios and index to be the same. These processes' efficacy is corroborated by the Korea Stock Price Index 200. Our experiments show a significant reduction of the prediction errors compared with historical estimations, and competitive tracking errors of replicating the index using fewer than half of the entire constituents. Therefore, we show that applying deep learning to predict market sensitivities is promising and that our portfolio construction methods are practically effective. Additionally, to our knowledge, this is the first study that addresses market sensitivities focused on deep learning.  ( 2 min )

Estimation of physical quantities is at the core of most scientific research and the use of quantum devices promises to enhance its performances. In real scenarios, it is fundamental to consider that the resources are limited and Bayesian adaptive estimation represents a powerful approach to efficiently allocate, during the estimation process, all the available resources. However, this framework relies on the precise knowledge of the system model, retrieved with a fine calibration that often results computationally and experimentally demanding. Here, we introduce a model-free and deep learning-based approach to efficiently implement realistic Bayesian quantum metrology tasks accomplishing all the relevant challenges, without relying on any a-priori knowledge on the system. To overcome this need, a neural network is trained directly on experimental data to learn the multiparameter Bayesian update. Then, the system is set at its optimal working point through feedbacks provided by a reinforcement learning algorithm trained to reconstruct and enhance experiment heuristics of the investigated quantum sensor. Notably, we prove experimentally the achievement of higher estimation performances than standard methods, demonstrating the strength of the combination of these two black-box algorithms on an integrated photonic circuit. This work represents an important step towards fully artificial intelligence-based quantum metrology.  ( 2 min )

Learning Electronic Health Records (EHRs) representation is a preeminent yet under-discovered research topic. It benefits various clinical decision support applications, e.g., medication outcome prediction or patient similarity search. Current approaches focus on task-specific label supervision on vectorized sequential EHR, which is not applicable to large-scale unsupervised scenarios. Recently, contrastive learning shows great success on self-supervised representation learning problems. However, complex temporality often degrades the performance. We propose Graph Kernel Infomax, a self-supervised graph kernel learning approach on the graphical representation of EHR, to overcome the previous problems. Unlike the state-of-the-art, we do not change the graph structure to construct augmented views. Instead, we use Kernel Subspace Augmentation to embed nodes into two geometrically different manifold views. The entire framework is trained by contrasting nodes and graph representations on those two manifold views through the commonly used contrastive objectives. Empirically, using publicly available benchmark EHR datasets, our approach yields performance on clinical downstream tasks that exceeds the state-of-the-art. Theoretically, the variation on distance metrics naturally creates different views as data augmentation without changing graph structures.  ( 2 min )

Several papers have rightly included minority groups in artificial intelligence (AI) training data to improve test inference for minority groups and/or society-at-large. A society-at-large consists of both minority and majority stakeholders. A common misconception is that minority inclusion does not increase performance for majority groups alone. In this paper, we make the surprising finding that including minority samples can improve test error for the majority group. In other words, minority group inclusion leads to majority group enhancements (MIME) in performance. A theoretical existence proof of the MIME effect is presented and found to be consistent with experimental results on six different datasets. Project webpage: https://visual.ee.ucla.edu/mime.htm/  ( 2 min )

In performative prediction, a predictive model impacts the distribution that generates future data, a phenomenon that is being ignored in classical supervised learning. In this closed-loop setting, the natural measure of performance, denoted the performative risk, captures the expected loss incurred by a predictive model after deployment. The core difficulty of minimizing the performative risk is that the data distribution itself depends on the model parameters. This dependence is governed by the environment and not under the control of the learner. As a consequence, even the choice of a convex loss function can result in a highly non-convex performative risk minimization problem. Prior work has identified a pair of general conditions on the loss and the mapping from model parameters to distributions that implies convexity of the performative risk. In this paper, we relax these assumptions and focus on obtaining weaker notions of convexity, without sacrificing the amenability of the performative risk minimization problem for iterative optimization methods.  ( 2 min )

The distribution shifts between training and test data typically undermine the performance of deep learning models. In recent years, lots of work pays attention to domain generalization (DG) where distribution shift exists and target data are unseen. Despite the progress in algorithm design, two foundational factors have long been ignored: 1) the optimization for regularization-based objectives (e.g., distribution alignment), and 2) the model selection for DG since no knowledge about the target domain can be utilized. In this paper, we propose Mixup guided optimization and selection techniques for domain generalization. For optimization, we utilize an adapted Mixup to generate an out-of-distribution dataset that can guide the preference direction and optimize with Pareto optimization. For model selection, we generate a validation dataset with a closer distance to the target distribution, and thereby it can better represent the target data. We also present some theoretical insights behind our proposals. Comprehensive experiments on one visual classification benchmark and three time-series benchmarks demonstrate that our model optimization and selection techniques can largely improve the performance of existing domain generalization algorithms and even achieve new state-of-the-art results.  ( 2 min )

When creating 3D content, highly specialized skills are generally needed to design and generate models of objects and other assets by hand. We address this problem through high-quality 3D asset retrieval from multi-modal inputs, including 2D sketches, images and text. We use CLIP as it provides a bridge to higher-level latent features. We use these features to perform a multi-modality fusion to address the lack of artistic control that affects common data-driven approaches. Our approach allows for multi-modal conditional feature-driven retrieval through a 3D asset database, by utilizing a combination of input latent embeddings. We explore the effects of different combinations of feature embeddings across different input types and weighting methods.  ( 2 min )

The ML community recognizes the importance of anticipating and mitigating the potential negative impacts of benchmark research. In this position paper, we argue that more attention needs to be paid to areas of ethical risk that lie at the technical and scientific core of ML benchmarks. We identify overlooked structural similarities between human IQ and ML benchmarks. Human intelligence and ML benchmarks share similarities in setting standards for describing, evaluating and comparing performance on tasks relevant to intelligence. This enables us to unlock lessons from feminist philosophy of science scholarship that need to be considered by the ML benchmark community. Finally, we outline practical recommendations for benchmark research ethics and ethics review.  ( 2 min )

Today, data collection has improved in various areas, and the medical domain is no exception. Auscultation, as an important diagnostic technique for physicians, due to the progress and availability of digital stethoscopes, lends itself well to applications of machine learning. Due to the large number of auscultations performed, the availability of data opens up an opportunity for more effective analysis of sounds where prognostic accuracy even among experts remains low. In this study, digital 6-channel auscultations of 45 patients were used in various machine learning scenarios, with the aim of distinguishing between normal and anomalous pulmonary sounds. Audio features (such as fundamental frequencies F0-4, loudness, HNR, DFA, as well as descriptive statistics of log energy, RMS and MFCC) were extracted using the Python library Surfboard. Windowing and feature aggregation and concatenation strategies were used to prepare data for tree-based ensemble models in unsupervised (fair-cut forest) and supervised (random forest) machine learning settings. The evaluation was carried out using 9-fold stratified cross-validation repeated 30 times. Decision fusion by averaging outputs for a subject was tested and found to be useful. Supervised models showed a consistent advantage over unsupervised ones, achieving mean AUC ROC of 0.691 (accuracy 71.11%, Kappa 0.416, F1-score 0.771) in side-based detection and mean AUC ROC of 0.721 (accuracy 68.89%, Kappa 0.371, F1-score 0.650) in patient-based detection.  ( 3 min )

Neural Networks (NNs) struggle to efficiently learn certain problems, such as parity problems, even when there are simple learning algorithms for those problems. Can NNs discover learning algorithms on their own? We exhibit a NN architecture that, in polynomial time, learns as well as any efficient learning algorithm describable by a constant-sized learning algorithm. For example, on parity problems, the NN learns as well as row reduction, an efficient algorithm that can be succinctly described. Our architecture combines both recurrent weight-sharing between layers and convolutional weight-sharing to reduce the number of parameters down to a constant, even though the network itself may have trillions of nodes. While in practice the constants in our analysis are too large to be directly meaningful, our work suggests that the synergy of Recurrent and Convolutional NNs (RCNNs) may be more powerful than either alone.  ( 2 min )

Imbalanced Data (ID) is a problem that deters Machine Learning (ML) models for achieving satisfactory results. ID is the occurrence of a situation where the quantity of the samples belonging to one class outnumbers that of the other by a wide margin, making such models learning process biased towards the majority class. In recent years, to address this issue, several solutions have been put forward, which opt for either synthetically generating new data for the minority class or reducing the number of majority classes for balancing the data. Hence, in this paper, we investigate the effectiveness of methods based on Deep Neural Networks (DNNs) and Convolutional Neural Networks (CNNs), mixed with a variety of well-known imbalanced data solutions meaning oversampling and undersampling. To evaluate our methods, we have used KEEL, breast cancer, and Z-Alizadeh Sani datasets. In order to achieve reliable results, we conducted our experiments 100 times with randomly shuffled data distributions. The classification results demonstrate that the mixed Synthetic Minority Oversampling Technique (SMOTE)-Normalization-CNN outperforms different methodologies achieving 99.08% accuracy on the 24 imbalanced datasets. Therefore, the proposed mixed model can be applied to imbalanced binary classification problems on other real datasets.  ( 2 min )

Due to the nonstationary nature, the distribution of real-world multivariate time series (MTS) changes over time, which is known as distribution drift. Most existing MTS forecasting models greatly suffer from the distribution drift and degrade the forecasting performance over time. Existing methods address distribution drift via adapting to the latest arrived data or self-correcting per the meta knowledge derived from future data. Despite their great success in MTS forecasting, these methods hardly capture the intrinsic distribution changes especially from a distributional perspective. Accordingly, we propose a novel framework temporal conditional variational autoencoder (TCVAE) to model the dynamic distributional dependencies over time between historical observations and future data in MTS and infer the dependencies as a temporal conditional distribution to leverage latent variables. Specifically, a novel temporal Hawkes attention mechanism represents temporal factors subsequently fed into feed-forward networks to estimate the prior Gaussian distribution of latent variables. The representation of temporal factors further dynamically adjusts the structures of Transformer-based encoder and decoder to distribution changes by leveraging a gated attention mechanism. Moreover, we introduce conditional continuous normalization flow to transform the prior Gaussian to a complex and form-free distribution to facilitate flexible inference of the temporal conditional distribution. Extensive experiments conducted on six real-world MTS datasets demonstrate the TCVAE's superior robustness and effectiveness over the state-of-the-art MTS forecasting baselines. We further illustrate the TCVAE applicability through multifaceted case studies and visualization in real-world scenarios.  ( 3 min )

Recent work has shown logical background knowledge can be used in learning systems to compensate for a lack of labeled training data. Many methods work by creating a loss function that encodes this knowledge. However, often the logic is discarded after training, even if it is still useful at test time. Instead, we ensure neural network predictions satisfy the knowledge by refining the predictions with an extra computation step. We introduce differentiable refinement functions that find a corrected prediction close to the original prediction. We study how to effectively and efficiently compute these refinement functions. Using a new algorithm called Iterative Local Refinement (ILR), we combine refinement functions to find refined predictions for logical formulas of any complexity. ILR finds refinements on complex SAT formulas in significantly fewer iterations and frequently finds solutions where gradient descent can not. Finally, ILR produces competitive results in the MNIST addition task.  ( 2 min )

Selecting a small set of informative features from a large number of possibly noisy candidates is a challenging problem with many applications in machine learning and approximate Bayesian computation. In practice, the cost of computing informative features also needs to be considered. This is particularly important for networks because the computational costs of individual features can span several orders of magnitude. We addressed this issue for the network model selection problem using two approaches. First, we adapted nine feature selection methods to account for the cost of features. We show for two classes of network models that the cost can be reduced by two orders of magnitude without considerably affecting classification accuracy (proportion of correctly identified models). Second, we selected features using pilot simulations with smaller networks. This approach reduced the computational cost by a factor of 50 without affecting classification accuracy. To demonstrate the utility of our approach, we applied it to three different yeast protein interaction networks and identified the best-fitting duplication divergence model.  ( 2 min )

Graphs are commonly used to represent and visualize causal relations. For a small number of variables, this approach provides a succinct and clear view of the scenario at hand. As the number of variables under study increases, the graphical approach may become impractical, and the clarity of the representation is lost. Clustering of variables is a natural way to reduce the size of the causal diagram, but it may erroneously change the essential properties of the causal relations if implemented arbitrarily. We define a specific type of cluster, called transit cluster, that is guaranteed to preserve the identifiability properties of causal effects under certain conditions. We provide a sound and complete algorithm for finding all transit clusters in a given graph and demonstrate how clustering can simplify the identification of causal effects. We also study the inverse problem, where one starts with a clustered graph and looks for extended graphs where the identifiability properties of causal effects remain unchanged. We show that this kind of structural robustness is closely related to transit clusters.  ( 2 min )

We present the extension of the Remember and Forget for Experience Replay (ReF-ER) algorithm to Multi-Agent Reinforcement Learning (MARL). ReF-ER was shown to outperform state of the art algorithms for continuous control in problems ranging from the OpenAI Gym to complex fluid flows. In MARL, the dependencies between the agents are included in the state-value estimator and the environment dynamics are modeled via the importance weights used by ReF-ER. In collaborative environments, we find the best performance when the value is estimated using individual rewards and we ignore the effects of other actions on the transition map. We benchmark the performance of ReF-ER MARL on the Stanford Intelligent Systems Laboratory (SISL) environments. We find that employing a single feed-forward neural network for the policy and the value function in ReF-ER MARL, outperforms state of the art algorithms that rely on complex neural network architectures.  ( 2 min )

Reinforcement learning algorithms require a large amount of samples; this often limits their real-world applications on even simple tasks. Such a challenge is more outstanding in multi-agent tasks, as each step of operation is more costly requiring communications or shifting or resources. This work aims to improve data efficiency of multi-agent control by model-based learning. We consider networked systems where agents are cooperative and communicate only locally with their neighbors, and propose the decentralized model-based policy optimization framework (DMPO). In our method, each agent learns a dynamic model to predict future states and broadcast their predictions by communication, and then the policies are trained under the model rollouts. To alleviate the bias of model-generated data, we restrain the model usage for generating myopic rollouts, thus reducing the compounding error of model generation. To pertain the independence of policy update, we introduce extended value function and theoretically prove that the resulting policy gradient is a close approximation to true policy gradients. We evaluate our algorithm on several benchmarks for intelligent transportation systems, which are connected autonomous vehicle control tasks (Flow and CACC) and adaptive traffic signal control (ATSC). Empirically results show that our method achieves superior data efficiency and matches the performance of model-free methods using true models.  ( 3 min )

We propose an algorithm for next query recommendation in interactive data exploration settings, like knowledge discovery for information gathering. The state-of-the-art query recommendation algorithms are based on sequence-to-sequence learning approaches that exploit historical interaction data. Due to the supervision involved in the learning process, such approaches fail to adapt to immediate user feedback. We propose to augment the transformer-based causal language models for query recommendations to adapt to the immediate user feedback using multi-armed bandit (MAB) framework. We conduct a large-scale experimental study using log files from a popular online literature discovery service and demonstrate that our algorithm improves the per-round regret substantially, with respect to the state-of-the-art transformer-based query recommendation models, which do not make use of immediate user feedback. Our data model and source code are available at https://github.com/shampp/exp3_ss  ( 2 min )

In this work, we introduce a differentially private method for generating synthetic data from vertically partitioned data, \emph{i.e.}, where data of the same individuals is distributed across multiple data holders or parties. We present a differentially privacy stochastic gradient descent (DP-SGD) algorithm to train a mixture model over such partitioned data using variational inference. We modify a secure multiparty computation (MPC) framework to combine MPC with differential privacy (DP), in order to use differentially private MPC effectively to learn a probabilistic generative model under DP on such vertically partitioned data. Assuming the mixture components contain no dependencies across different parties, the objective function can be factorized into a sum of products of the contributions calculated by the parties. Finally, MPC is used to compute the aggregate between the different contributions. Moreover, we rigorously define the privacy guarantees with respect to the different players in the system. To demonstrate the accuracy of our method, we run our algorithm on the Adult dataset from the UCI machine learning repository, where we obtain comparable results to the non-partitioned case.  ( 2 min )

In this note, we study how neural networks with a single hidden layer and ReLU activation interpolate data drawn from a radially symmetric distribution with target labels 1 at the origin and 0 outside the unit ball, if no labels are known inside the unit ball. With weight decay regularization and in the infinite neuron, infinite data limit, we prove that a unique radially symmetric minimizer exists, whose weight decay regularizer and Lipschitz constant grow as $d$ and $\sqrt{d}$ respectively. We furthermore show that the weight decay regularizer grows exponentially in $d$ if the label $1$ is imposed on a ball of radius $\varepsilon$ rather than just at the origin. By comparison, a neural networks with two hidden layers can approximate the target function without encountering the curse of dimensionality.  ( 2 min )

The ability to discover new transients via image differencing without direct human intervention is an important task in observational astronomy. For these kind of image classification problems, machine Learning techniques such as Convolutional Neural Networks (CNNs) have shown remarkable success. In this work, we present the results of an automated transient identification on images with CNNs for an extant dataset from the Dark Energy Survey Supernova program (DES-SN), whose main focus was on using Type Ia supernovae for cosmology. By performing an architecture search of CNNs, we identify networks that efficiently select non-artifacts (e.g. supernovae, variable stars, AGN, etc.) from artifacts (image defects, mis-subtractions, etc.), achieving the efficiency of previous work performed with random Forests, without the need to expend any effort in feature identification. The CNNs also help us identify a subset of mislabeled images. Performing a relabeling of the images in this subset, the resulting classification with CNNs is significantly better than previous results.  ( 2 min )

As a special infinite-order vector autoregressive (VAR) model, the vector autoregressive moving average (VARMA) model can capture much richer temporal patterns than the widely used finite-order VAR model. However, its practicality has long been hindered by its non-identifiability, computational intractability, and relative difficulty of interpretation. This paper introduces a novel infinite-order VAR model that not only avoids the drawbacks of the VARMA model but inherits its favorable temporal patterns. As another attractive feature, the temporal and cross-sectional dependence structures of this model can be interpreted separately, since they are characterized by different sets of parameters. For high-dimensional time series, this separation motivates us to impose sparsity on the parameters determining the cross-sectional dependence. As a result, greater statistical efficiency and interpretability can be achieved without sacrificing any temporal information. We introduce an $\ell_1$-regularized estimator for the proposed model and derive the corresponding non-asymptotic error bounds. An efficient block coordinate descent algorithm and a consistent model order selection method are developed. The merit of the proposed approach is supported by simulation studies and a real-world macroeconomic data analysis.  ( 2 min )

Choosing a publication venue for an academic paper is a crucial step in the research process. However, in many cases, decisions are based solely on the experience of researchers, which often leads to suboptimal results. Although there exist venue recommender systems for academic papers, they recommend venues where the paper is expected to be published. In this study, we aim to recommend publication venues from a different perspective. We estimate the number of citations a paper will receive if the paper is published in each venue and recommend the venue where the paper has the most potential impact. However, there are two challenges to this task. First, a paper is published in only one venue, and thus, we cannot observe the number of citations the paper would receive if the paper were published in another venue. Secondly, the contents of a paper and the publication venue are not statistically independent; that is, there exist selection biases in choosing publication venues. In this paper, we formulate the venue recommendation problem as a treatment effect estimation problem. We use a bias correction method to estimate the potential impact of choosing a publication venue effectively and to recommend venues based on the potential impact of papers in each venue. We highlight the effectiveness of our method using paper data from computer science conferences.  ( 3 min )

We study the problem of estimating the density $f(\boldsymbol x)$ of a random vector ${\boldsymbol X}$ in $\mathbb R^d$. For a spanning tree $T$ defined on the vertex set $\{1,\dots ,d\}$, the tree density $f_{T}$ is a product of bivariate conditional densities. An optimal spanning tree minimizes the Kullback-Leibler divergence between $f$ and $f_{T}$. From i.i.d. data we identify an optimal tree $T^*$ and efficiently construct a tree density estimate $f_n$ such that, without any regularity conditions on the density $f$, one has $\lim_{n\to \infty} \int |f_n(\boldsymbol x)-f_{T^*}(\boldsymbol x)|d\boldsymbol x=0$ a.s. For Lipschitz $f$ with bounded support, $\mathbb E \left\{ \int |f_n(\boldsymbol x)-f_{T^*}(\boldsymbol x)|d\boldsymbol x\right\}=O\big(n^{-1/4}\big)$, a dimension-free rate.  ( 2 min )

We study one of the key tools in data approximation and optimization: low-discrepancy colorings. Formally, given a finite set system $(X,\mathcal S)$, the \emph{discrepancy} of a two-coloring $\chi:X\to\{-1,1\}$ is defined as $\max_{S \in \mathcal S}|{\chi(S)}|$, where $\chi(S)=\sum\limits_{x \in S}\chi(x)$. We propose a randomized algorithm which, for any $d>0$ and $(X,\mathcal S)$ with dual shatter function $\pi^*(k)=O(k^d)$, returns a coloring with expected discrepancy $O\left({\sqrt{|X|^{1-1/d}\log|\mathcal S|}}\right)$ (this bound is tight) in time $\tilde O\left({|\mathcal S|\cdot|X|^{1/d}+|X|^{2+1/d}}\right)$, improving upon the previous-best time of $O\left(|\mathcal S|\cdot|X|^3\right)$ by at least a factor of $|X|^{2-1/d}$ when $|\mathcal S|\geq|X|$. This setup includes many geometric classes, families of bounded dual VC-dimension, and others. As an immediate consequence, we obtain an improved algorithm to construct $\varepsilon$-approximations of sub-quadratic size. Our method uses primal-dual reweighing with an improved analysis of randomly updated weights and exploits the structural properties of the set system via matchings with low crossing number -- a fundamental structure in computational geometry. In particular, we get the same $|X|^{2-1/d}$ factor speed-up on the construction time of matchings with crossing number $O\left({|X|^{1-1/d}}\right)$, which is the first improvement since the 1980s. The proposed algorithms are very simple, which makes it possible, for the first time, to compute colorings with near-optimal discrepancies and near-optimal sized approximations for abstract and geometric set systems in dimensions higher than $2$.  ( 3 min )

Surprising events trigger measurable brain activity and influence human behavior by affecting learning, memory, and decision-making. Currently there is, however, no consensus on the definition of surprise. Here we identify 18 mathematical definitions of surprise in a unifying framework. We first propose a technical classification of these definitions into three groups based on their dependence on an agent's belief, show how they relate to each other, and prove under what conditions they are indistinguishable. Going beyond this technical analysis, we propose a taxonomy of surprise definitions and classify them into four conceptual categories based on the quantity they measure: (i) 'prediction surprise' measures a mismatch between a prediction and an observation; (ii) 'change-point detection surprise' measures the probability of a change in the environment; (iii) 'confidence-corrected surprise' explicitly accounts for the effect of confidence; and (iv) 'information gain surprise' measures the belief-update upon a new observation. The taxonomy poses the foundation for principled studies of the functional roles and physiological signatures of surprise in the brain.  ( 2 min )

We study the effect of normalization on the layers of deep neural networks of feed-forward type. A given layer $i$ with $N_{i}$ hidden units is allowed to be normalized by $1/N_{i}^{\gamma_{i}}$ with $\gamma_{i}\in[1/2,1]$ and we study the effect of the choice of the $\gamma_{i}$ on the statistical behavior of the neural network's output (such as variance) as well as on the test accuracy on the MNIST data set. We find that in terms of variance of the neural network's output and test accuracy the best choice is to choose the $\gamma_{i}$'s to be equal to one, which is the mean-field scaling. We also find that this is particularly true for the outer layer, in that the neural network's behavior is more sensitive in the scaling of the outer layer as opposed to the scaling of the inner layers. The mechanism for the mathematical analysis is an asymptotic expansion for the neural network's output. An important practical consequence of the analysis is that it provides a systematic and mathematically informed way to choose the learning rate hyperparameters. Such a choice guarantees that the neural network behaves in a statistically robust way as the $N_i$ grow to infinity.  ( 2 min )

In the context of modern environmental and societal concerns, there is an increasing demand for methods able to identify management strategies for civil engineering systems, minimizing structural failure risks while optimally planning inspection and maintenance (I&M) processes. Most available methods simplify the I&M decision problem to the component level due to the computational complexity associated with global optimization methodologies under joint system-level state descriptions. In this paper, we propose an efficient algorithmic framework for inference and decision-making under uncertainty for engineering systems exposed to deteriorating environments, providing optimal management strategies directly at the system level. In our approach, the decision problem is formulated as a factored partially observable Markov decision process, whose dynamics are encoded in Bayesian network conditional structures. The methodology can handle environments under equal or general, unequal deterioration correlations among components, through Gaussian hierarchical structures and dynamic Bayesian networks. In terms of policy optimization, we adopt a deep decentralized multi-agent actor-critic (DDMAC) reinforcement learning approach, in which the policies are approximated by actor neural networks guided by a critic network. By including deterioration dependence in the simulated environment, and by formulating the cost model at the system level, DDMAC policies intrinsically consider the underlying system-effects. This is demonstrated through numerical experiments conducted for both a 9-out-of-10 system and a steel frame under fatigue deterioration. Results demonstrate that DDMAC policies offer substantial benefits when compared to state-of-the-art heuristic approaches. The inherent consideration of system-effects by DDMAC strategies is also interpreted based on the learned policies.  ( 3 min )

Motivation: The development of novel compounds targeting proteins of interest is one of the most important tasks in the pharmaceutical industry. Deep generative models have been applied to targeted molecular design and have shown promising results. Recently, target-specific molecule generation has been viewed as a translation between the protein language and the chemical language. However, such a model is limited by the availability of interacting protein-ligand pairs. On the other hand, large amounts of unlabeled protein sequences and chemical compounds are available and have been used to train language models that learn useful representations. In this study, we propose exploiting pretrained biochemical language models to initialize (i.e. warm start) targeted molecule generation models. We investigate two warm start strategies: (i) a one-stage strategy where the initialized model is trained on targeted molecule generation (ii) a two-stage strategy containing a pre-finetuning on molecular generation followed by target specific training. We also compare two decoding strategies to generate compounds: beam search and sampling. Results: The results show that the warm-started models perform better than a baseline model trained from scratch. The two proposed warm-start strategies achieve similar results to each other with respect to widely used metrics from benchmarks. However, docking evaluation of the generated compounds for a number of novel proteins suggests that the one-stage strategy generalizes better than the two-stage strategy. Additionally, we observe that beam search outperforms sampling in both docking evaluation and benchmark metrics for assessing compound quality. Availability and implementation: The source code is available at https://github.com/boun-tabi/biochemical-lms-for-drug-design and the materials are archived in Zenodo at https://doi.org/10.5281/zenodo.6832145  ( 3 min )

To understand the origins of materials properties, neutron scattering experiments at three-axes spectrometers (TAS) investigate magnetic and lattice excitations in a sample by measuring intensity distributions in its momentum (Q) and energy (E) space. The high demand and limited availability of beam time for TAS experiments however raise the natural question whether we can improve their efficiency or make better use of the experimenter's time. In fact, using TAS, there are a number of scientific questions that require searching for signals of interest in a particular region of Q-E space, but when done manually, it is time consuming and inefficient since the measurement points may be placed in uninformative regions such as the background. Active learning is a promising general machine learning approach that allows to iteratively detect informative regions of signal autonomously, i.e., without human interference, thus avoiding unnecessary measurements and speeding up the experiment. In addition, the autonomous mode allows experimenters to focus on other relevant tasks in the meantime. The approach that we describe in this article exploits log-Gaussian processes which, due to the log transformation, have the largest approximation uncertainties in regions of signal. Maximizing uncertainty as an acquisition function hence directly yields locations for informative measurements. We demonstrate the benefits of our approach on outcomes of a real neutron experiment at the thermal TAS EIGER (PSI) as well as on results of a benchmark in a synthetic setting including numerous different excitations.  ( 3 min )

Predicting the economy's short-term dynamics -- a vital input to economic agents' decision-making process -- often uses lagged indicators in linear models. This is typically sufficient during normal times but could prove inadequate during crisis periods. This paper aims to demonstrate that non-traditional and timely data such as retail and wholesale payments, with the aid of nonlinear machine learning approaches, can provide policymakers with sophisticated models to accurately estimate key macroeconomic indicators in near real-time. Moreover, we provide a set of econometric tools to mitigate overfitting and interpretability challenges in machine learning models to improve their effectiveness for policy use. Our models with payments data, nonlinear methods, and tailored cross-validation approaches help improve macroeconomic nowcasting accuracy up to 40\% -- with higher gains during the COVID-19 period. We observe that the contribution of payments data for economic predictions is small and linear during low and normal growth periods. However, the payments data contribution is large, asymmetrical, and nonlinear during strong negative or positive growth periods.  ( 2 min )

Indirect discrimination is an issue of major concern in algorithmic models. This is particularly the case in insurance pricing where protected policyholder characteristics are not allowed to be used for insurance pricing. Simply disregarding protected policyholder information is not an appropriate solution because this still allows for the possibility of inferring the protected characteristics from the non-protected ones. This leads to so-called proxy or indirect discrimination. Though proxy discrimination is qualitatively different from the group fairness concepts in machine learning, these group fairness concepts are proposed to 'smooth out' the impact of protected characteristics in the calculation of insurance prices. The purpose of this note is to share some thoughts about group fairness concepts in the light of insurance pricing and to discuss their implications. We present a statistical model that is free of proxy discrimination, thus, unproblematic from an insurance pricing point of view. However, we find that the canonical price in this statistical model does not satisfy any of the three most popular group fairness axioms. This seems puzzling and we welcome feedback on our example and on the usefulness of these group fairness axioms for non-discriminatory insurance pricing.  ( 2 min )

Federated learning refers to the task of performing machine learning with decentralized data from multiple clients while protecting data security and privacy. Works have been done to incorporate quantum advantage in such scenarios. However, when the clients' data are not independent and identically distributed (IID), the performance of conventional federated algorithms deteriorates. In this work, we explore this phenomenon in the quantum regime with both theoretical and numerical analysis. We further prove that a global quantum channel can be exactly decomposed into channels trained by each client with the help of local density estimators. It leads to a general framework for quantum federated learning on non-IID data with one-shot communication complexity. We demonstrate it on classification tasks with numerical simulations.  ( 2 min )

In performative prediction, a predictive model impacts the distribution that generates future data, a phenomenon that is being ignored in classical supervised learning. In this closed-loop setting, the natural measure of performance, denoted the performative risk, captures the expected loss incurred by a predictive model after deployment. The core difficulty of minimizing the performative risk is that the data distribution itself depends on the model parameters. This dependence is governed by the environment and not under the control of the learner. As a consequence, even the choice of a convex loss function can result in a highly non-convex performative risk minimization problem. Prior work has identified a pair of general conditions on the loss and the mapping from model parameters to distributions that implies convexity of the performative risk. In this paper, we relax these assumptions and focus on obtaining weaker notions of convexity, without sacrificing the amenability of the performative risk minimization problem for iterative optimization methods.  ( 2 min )

Preconditioning has been a staple technique in optimization and machine learning. It often reduces the condition number of the matrix it is applied to, thereby speeding up convergence of optimization algorithms. Although there are many popular preconditioning techniques in practice, most lack theoretical guarantees for reductions in condition number. In this paper, we study the problem of optimal diagonal preconditioning to achieve maximal reduction in the condition number of any full-rank matrix by scaling its rows or columns separately or simultaneously. We first reformulate the problem as a quasi-convex problem and provide a baseline bisection algorithm that is easy to implement in practice, where each iteration consists of an SDP feasibility problem. Then we propose a polynomial time potential reduction algorithm with $O(\log(\frac{1}{\epsilon}))$ iteration complexity, where each iteration consists of a Newton update based on the Nesterov-Todd direction. Our algorithm is based on a formulation of the problem which is a generalized version of the Von Neumann optimal growth problem. Next, we specialize to one-sided optimal diagonal preconditioning problems, and demonstrate that they can be formulated as standard dual SDP problems, to which we apply efficient customized solvers and study the empirical performance of our optimal diagonal preconditioners. Our extensive experiments on large matrices demonstrate the practical appeal of optimal diagonal preconditioners at reducing condition numbers compared to heuristics-based preconditioners.  ( 3 min )

Neural Networks (NNs) struggle to efficiently learn certain problems, such as parity problems, even when there are simple learning algorithms for those problems. Can NNs discover learning algorithms on their own? We exhibit a NN architecture that, in polynomial time, learns as well as any efficient learning algorithm describable by a constant-sized learning algorithm. For example, on parity problems, the NN learns as well as row reduction, an efficient algorithm that can be succinctly described. Our architecture combines both recurrent weight-sharing between layers and convolutional weight-sharing to reduce the number of parameters down to a constant, even though the network itself may have trillions of nodes. While in practice the constants in our analysis are too large to be directly meaningful, our work suggests that the synergy of Recurrent and Convolutional NNs (RCNNs) may be more powerful than either alone.  ( 2 min )

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I am struggling to understand why the DQN algorithm fails in my environment -after a short rise at the beginning, the reward falls and remains low for more than 1e6 steps- but its distributional version (C51) achieves excellent results. I'm using RLlib implementations, so it's not a bug in my code. I would understand why C51 would learn faster, but what can be the reasons that prevent DQN to learn anything at all? One explanation I gave to myself is that in my environment the value for a given state can be quite noisy, and DQN learns only the expected value of the outcome, while C51 learns the distribution of possible outcomes. However, C51 still uses the expected value to choose the argmax action, so wouldn't the result be the same? Another possible explanation is that in my environment good performance corresponds to a region of small negative rewards, so gradient updates are much larger for low-reward batches, while this doesn't happen in C51. However, gradient clipping doesn't seem to be much effective. Do you know any other possible explanation? submitted by /u/fedetask [link] [comments]  ( 88 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

I have a toy RL project implementing he REINFORCE algorithm with a policy gradient agent that seems to be consistently learning to choose actions that reliably generate negative rewards. Are there any likely reasons this could be so? Additional details below. The rules of the environment are of my own design. Since that makes it obviously hard to diagnose, I'll take whatever high or low granularity suggestions I can get. --------- My environment is a 25x25 grid upon which a bot can move and attempt to acquire a target. Bots can choose the following 17 actions: Do nothing Move 1 space (in any of the 8 directions surrounding it) Attempt to acquire a target 1 space away (in any of the 8 directions surrounding it) The reward system is such that: +1 for moving closer to any targe…  ( 92 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

Hi community. I am very new to the field and I find myself in need for some guide to begin a project applied to UAVs. My context is the following. I am experimenting with decision making of autonomous Multi-agent UAVs in a simulated environment. My problem arises when attemting to represent the n number of other agents seen by a particular one in order to make a decision. As far as I have seen, the input size of the state vector is of fixed lenght, so how could one represent an unknown number of agents? (each with it's vector representing it's relative position in space)? I am aware of padding, but I was looking for a more (elegant?) and most importantly scalable solution. Thanks in advance and please forgive my ignorance on the topic. submitted by /u/Bensimon_Joules [link] [comments]  ( 88 min )

Hi everyone thank you so much in advance. Relative newbie here to open ai gym. I was wondering how I can change an environment like the taxi environment such as adding in more destination points, passengers, larger grid size, etc? Do you have any pointers or recommendations? I greatly appreciate it! submitted by /u/No_Opportunity575 [link] [comments]  ( 102 min )

Hello all, I am building a custom Reinforcement Learning trading environment using gym.Env for my masters dissertation. I finished developing it and I passed it through the stable_baseline3 check_env function. The environment did not raise any issues. Now I am trying to implement a quick RL algorithm to check if everything is set up correctly. I would really appreciate if anyone can give me some clarity what I am doing wrong. Here is my action space and observation space: self._data = df.copy() self.action_space = gym.spaces.Box(low=np.array([0, 0]), high=np.array([3, 1], dtype=np.float32)) # Store the columns to be shown to the agent self._columns = list(self._data.columns)[1:21] self._low = min(list(self._data[self._columns].min())) self._high = max(list(self._data[self._columns].max…  ( 99 min )

I am trying to learn machine learning. I have one hang up that I cannot find the answer to: How does a model fit inputs from a training data set? For example, I am working with the MNIST training set. When I fit the data using a particular model, how does it do it? All I am finding are articles with the syntax for code to do this. I am trying to understand what is happening one layer deeper? Does this make sense? I am not even sure what keywords should I I use to search for this on goggle. submitted by /u/NetworkPoker [link] [comments]  ( 90 min )

Peacasso - a UI for interacting with stable diffusion models. As text to image models become smaller, with available weights and generate competitive images (e.g. stable diffusion models), there have been efforts to build interfaces for interacting with these models. Code and instructutions can be found on Github - https://github.com/victordibia/peacasso. ​ https://i.redd.it/t65hvd8tdwl91.gif There are many excellent UI interfaces that have been build for latent diffusion models recently, however some of the things Peacasso brings to the table include: Easy installation. Instead of cobbling together command line scripts, Peacasso provides a pip install flow and a UI that supports a set of carefully selected default operations. UI with good defaults. The current implementation of Peacasso provides a UI for basic operations - text and image based prompting, remixing generated images as prompts, model parameter selection. Also the little things .. like light and dark mode. Python API. While the UI is the focus here, there is an underlying python api which will bake in experimentation features (e.g. saving intermediate images in the sampling loop, exploring model explanations etc. . see roadmap ). ​ Light Mode ​ Dark mode submitted by /u/vykthur [link] [comments]  ( 90 min )

Hi, I have a question regarding taking the gradient twice, once wrt the input and once wrt to parameters and what one might have to pay attention to optimize the whole thing. Context: I have a neural network f(x,\theta) with a target y and it's output and gradient wrt to x occur in the loss which is calculated as L{ f(x, \theta), \nabla_x f(x, \theta), y }. The use case are differential equations. This means that to obtain the loss, I have to take gradient of the prediction f(x, \theta) once for the input x. Thereafter I take the gradient wrt to the parameters to do gradient descent as usual. I use twice differentiable activation functions (tanh, gelu, sigmoid etc). Problem: The model works for low dimensions but scales poorly to higher dimensional data. Question: Does anybody have recommendations, resources or links with regard to twice differentiable neural networks and how stochastic gradient descent is done with them, respectively what one has to pay to attention to while optimizing them (learning rates, momenta, weight decay etc) ? A resource with a similar setup is described in the Hamiltonian Neural Network paper by Greydanus et al (https://arxiv.org/pdf/1906.01563.pdf) which also computes the gradients of the parameters after taking the gradient wrt the input. Thanks in advance dear fellow gradient descenter :) submitted by /u/ludixiv [link] [comments]  ( 92 min )

Intuitively, can generative models be understood as learning to "interpolate" between the training data? For example, in the case of score-based models, my understanding is that the minimizer of the loss is any distribution where the score is 0 for each of the noise-perturbed training data - i.e., a distribution with (at least) *n* modes (*n* is training data size). Then, we do a gradient ascent on the distribution and add some Langevin noise so that the final sample (for example, an image) is not just images from the training data. What is the relation of the objects as we see them in this image to the objects in images from the training data? submitted by /u/a1_jakesauce_ [link] [comments]  ( 89 min )

I think it is important to understand the capabilities of these technologies beyond just making art. What these text to image models are capable of is massive compression of visual data that is orders of magnitude better then what we currently have. Right now if I wanted to share any image I created with stable diffusion, I do not have to share the image with you. I could just give you the metadata for the settings used to generate the said image and save a tremendous amount of bandwidth and hard drive space. Now you might be thinking that's great and all but what's my point. Well imagine if you are running a massive website that hosts generated images. All of those images are taking up a lot of space on server hard drives which you have to pay to host. Also there is massive amount of ban…  ( 112 min )

Hello, I am the creator of the VkFFT - GPU Fast Fourier Transform library for Vulkan/CUDA/HIP/OpenCL and Level Zero. Two weeks ago I made a post about Rader's algorithm implementation in VkFFT, which improved the performance of VkFFT for sequences not decomposable as small primes multiplication. The previous version of VkFFT was doing direct multiplication convolutions of length N-1 to create an FFT kernel of an arbitrary prime length to be used in a regular Stockham FFT algorithm. Direct multiplication convolutions scale as O(N^2) and do not work well for primes after 100. This update brings support for the convolution theorem Rader's algorithm, which no other GPU FFT library currently has. The new version does the Rader algorithm by inlining an FFT convolution in the FFT code - with FF…  ( 113 min )

As you know, mlflow is widely used today in the machine learning communiting to manage experimentation and serve models. In this series, I published on medium, I address the problem of scalability that I faced in my company while deploying multiple models in production using mlflow. ​ https://preview.redd.it/jzl3sb5z8vl91.png?width=700&format=png&auto=webp&s=43c15d7167399591e6db13b175530735a8b85039 In this series, I wrote about: Deploying an mlflow tracking instance to experiment Serving ml models as APIs endpoints on kubernetes. Understanding how k8s handles charge through Load testing The last article explains how you can make the deployment scalable, anticipate the computation power needed to handle multiple simultaneous requests in a real world context. submitted by /u/Spirited-Singer-6150 [link] [comments]  ( 89 min )

I am looking to get into the model compression field, especially in the post-train/fine-tuning phases (i.e., quantization, pruning). What are some canonical papers in the field? Is there any must-read book/survey paper? What are the most glaring problems and the most promising research avenues (in your opinion)? submitted by /u/Disastrous-War-9675 [link] [comments]  ( 88 min )

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Gradient descent is straightforward, you can see it obviously in 2d, getting stuck in local minima, etc. Backprop likewise makes sense in the case of a couple of neurons and a couple of layers, toy problems, etc. But why is it obvious that this process should work in ultra high dimensional space as well? I mean it's obvious there is structure in visual/audio/language data, and it makes sense you would be able to learn a representation of that structure by some method. But it's not at all obvious to me that backprop should "work" in that it should converge to anything generically useful for such data. It bothers me to have that missing intuition. How do you guys mentally resolve this? Do you just say "if it works it works" and get on with it? What is the latest SOTA thinking around a theoretical foundation for deep learning? Not a researcher myself - just a curious data scientist who works with them and occasionally reads papers on weekends. Would be happy to read any papers/blogs/posts on the topic as it stands now in mid 2022. submitted by /u/thunderdome [link] [comments]  ( 119 min )

Could we use a diffusion model to solve the traveling salesman problem in polynomial time? I don't know but I think we could do that by trying to randomize the path of an exactly solved TSP and then try to make the machine learn to reverse the process. If my guess is correct, we could exactly solve the TSP in polynomial time. Seems like the recently published Riemannian diffusion model could do that. submitted by /u/flat_rain [link] [comments]  ( 89 min )

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Basically I’m majoring in computer science and will very likely double major in math (as I’m more interested in it rather than cs but majoring in math only will bar me from participating in ml or ai classes or research due to my university rules) So my question is should I focus on machine learning solely or try to build some breadth and care about ml later on? I know this might sound like a silly question but it’s hard to decide since I’m afraid of pigeon holing my self into some niche field of ml or some thing like that? I’ll add more points to my post later on once I come back from work but hope the question is understandable and doesn’t break any sub rules thank you. submitted by /u/djssoapappskdid [link] [comments]  ( 92 min )

Hello, everyone. I have a question regarding to the tittle. So i have a thesis about Automatic tagging topic and i have to make the project about it. So my lecturer give 2 journal references, they are about automatic tagging and tag recommendation system. And i just confused about them. are they have same goal to make auto-tagging for the object ? why my lecturer give me these references? does tag recommendation system have to put into the automatic tagging ? Anyway i am still in the making of methodology step. Thank you. submitted by /u/TohingWahing [link] [comments]  ( 105 min )

Hey there! Has anyone here gone through the program before? Or are there any OpenAI people who can offer insight into the program? Maybe someone who is willing to share their experience and how to best prep for the program? I've seen various discussions on r/MachineLearning for the research track, but none about this program submitted by /u/ThrowawayTartan [link] [comments]  ( 90 min )

every ai out there somehow does a phenomenal job at creating landscapes and scenery and such and even extremely realistic portrays of humans, yet google doesnt give me a clear answer on any ai generator that can create cartoon characters based on the style of X or Y. i kinda wanted to see what i could create using ai and if itd be possible to create channel art or cartoon avatars that look like me for my youtube banner and videos. is there anything out there like this or would i have to find someone to draw something for me or use an online avatar creator that just uses a template? submitted by /u/blxoom [link] [comments]  ( 88 min )

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Cancer is partially a developmental illness, with malignancies named for the cell or tissue from which they originate. However, there is no systematic atlas of tumor sources. Identifying a patient’s precise type of cancer and its main site is the first step in deciding on the best course of treatment. Despite extensive testing, the source of cancer cannot be determined in many situations. Oncologists must employ non-targeted medicines with severe side effects and poor survival rates. Researchers at Massachusetts General Hospital (MGH) and the Koch Institute for Integrative Cancer Research at MIT may help classify cancers of unknown primary. Their work introduces a new deep learning method by closely examining the gene expression patterns related to early cell development and differentiation. Continue reading | Check out the paper submitted by /u/ai-lover [link] [comments]  ( 87 min )

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I am have not had much luck finding decent work with my philosophy degree and am considering an MA in AI. As it stands I don't know much at all and am in the very early stages of getting to grips with the topic and deciding whether it's something I could really do. With that in mind, do you guys have any recommendations for introductory books on the topic? There's plenty of content online, but I'd prefer a proper book that's a little more in depth. submitted by /u/Snedwardthe18th [link] [comments]  ( 88 min )

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I built a simple chatbot with NextJS for my final year project, but I'm having trouble training it. Xalen is a self-learning conversational chatbot designed to hold funny and witty conversations with users through artificial intelligence methods that enable the program to communicate like an actual human being. It can talk about anything (eventually), tell jokes, engage in witty banter, etc. It's generally for entertainment purposes. Xalen learns from each and every conversation, becoming better and more intelligent, improving its ability to hold longer and more meaningful conversations. Due to a lack of sufficient data, its responses aren't perfect right now, but they can definitely improve! I need a lot of people to chat with the bot. The longer the conversation the better. Your help is greatly appreciated... Here's the URL: http://xalen.netlify.app Thank you all in advance! submitted by /u/GameTide [link] [comments]  ( 88 min )

I honestly would love a Colab Notebook for a hand drawn animation generator where you import the storyboards, animatics, backgrounds, model sheets, time sheet/exposure sheets, etc. Though it wouldn't be a substitute for animating yourself, but could be useful if unmotivated. Also, I would love it to have various styles of studios that have done hand drawn animation before (Kinda like Jukebox AI where it has various styles of composers). Especially, defunct ones. No one has ever done an animation generator like this, so it could be a unique one. A time sheet, aka exposure sheet is a wide document with directions for the animators on what to draw for each frame. Here's some examples by me and a former sheet timer of mine named Emery. They sadly left due to personal stuff. https://drive.google.com/file/d/1wbhT3gmCgWQGJYLtYSfgcdf6Z-A6YOJk/view?usp=drivesdk https://drive.google.com/file/d/1n3D4CHJXx6VEBrKWmcmvUBFUMz4Reff6/view?usp=drivesdk https://drive.google.com/file/d/1ckZPfKHQ0gHvKrSGfH-F8PI5HKbEQDlZ/view?usp=drivesdk https://drive.google.com/file/d/1cTj83apBrFJst4sfISwG_tJFZMP-HJtf/view?usp=drivesdk submitted by /u/Ooglyeye [link] [comments]  ( 87 min )

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I’ve had to work a little with VIN numbers lately, and so I looked back at a post I wrote on the subject three years ago. That post goes into the details of Vehicle Identification Numbers and the quirky algorithm used to compute the check sum. This post captures the algorithm in Python code. See […] Computing VIN checksums first appeared on John D. Cook.  ( 5 min )

submitted by /u/Ragdoll_X_Furry [link] [comments]  ( 88 min )

Dear students, researchers and practioners, I don't know about you guys but in terms of ML hyperparameter tuning is what "keeps me up at night". Even if your model is convex, closed form finding the (near-)optimal hyperparameters is still always a non-convex problem. Yes you can do a random search search with a large n, cv on each point and then grid around the n best results but I don't always have the time, compute or simply the "mental energy" to do this. This is why I actively avoid neural networks for non-text, vision and even try to wing it with OpenCV if the problem is easy enough. Everything in neural networks is a hyper parameter and for enough datasets there's no clear point you can say "mmkay I'm sure I got everything out of my model" unless you hit 100 % on val, test. Some models on tabular data, e.g. GBDT's, seem not to be sensitive towards hyperparameters unless you have unbalanced data or so. Even better, if I can wing it with LDA/QDA and use 0 hyperparameters I'm happy. Have there been any large scale studies that look at algorithms from this point of view? If not, is this not an interesting domain to research? submitted by /u/Aggressive_Ad_3178 [link] [comments]  ( 91 min )

I m going to buy a new laptop and the only thing that concerns me is whether I am overspending for laptop in GPU. I am doing my BTech in Artificial intelligence. And my task includes running heavy softwares like visual studio, Android studio, matlab, etc. simultaneously. So the question is, do i need to buy a laptop with dedicated GPU for long run? If not, which intel or ryzen processors will do the job? submitted by /u/Relative_Winner_4588 [link] [comments]  ( 92 min )

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In VQ-GAN, when sampling new images for unconditional image generation, you run a Transformer to predict the sequence of codebook vectors that define the latent representation of the image, and then you run that latent representation through your decoder to generate an actual image. But does the only randomness come from the sampling of the predicted sequence? If so, I get that the number of possible images to generate is mind shatteringly huge (1024256), but it still seems limited. Like, if you generate a particular image, it seems like you wouldn't be able to generate very similar images that are close enough that they'd still (imperfectly) map to the same codebook entries when run through the first stage encoder. Is there any other noise applied (e.g. slight perturbations to the chosen codebook vectors, Adaptive Instance Normalization in the decoder a la StyleGAN), or does the discrete set of vector sequences really define the full, discrete set of outputs? submitted by /u/say_wot_again [link] [comments]  ( 89 min )

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Hi there, I have set up a basic implementation for Dual Numbers in Python that can be used for automatic differentiation. Here is an example that is also part of the repository: ​ Gradient descent with dual numbers. The implementation is pretty simple and therefore easy to understand. https://github.com/kaifishr/PyDualNumber submitted by /u/neurontwister [link] [comments]  ( 105 min )

I was reading this article. For those of you who got paywalled, a short summary of the controversy is that someone entered one of his results from midjourney to Colorado State Fair’s art competition. He played around with midjourney, and submitted one of the outcomes to the fair with “adequate” credit - Jason Allen via midjourney. (This is also controversial as some judges didn’t know anything about midjourney). He won his division, which is digital art. Obviously, there are some pretty heated arguments on Twitter on this matter among digital artists. Some argue that he’s not an artist that he did bare minimum work. There’s no creativity or leg work to create it. He didn’t write the code. He simply came up with a prompt. Some argue that this is valid, because AI tools are merely tools, and every artists use tools. They think it’s not any different than photoshop. submitted by /u/KimiKimKimKitty [link] [comments]  ( 113 min )

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Hello, I have a few questions regarding deep learning based human pose estimation that I would appreciate some help with: Firstly, I understand that pitch and yaw of a bone segment, such as the forearm, can be calculated using 2d or 3d joint keypoints but roll cannot. Could someone explain to me why it is not possible to calculate roll of the forearm using wrist and elbow keypoints? Secondly, I am confused on the exact difference between orientation map representations of the human body such as those used in openpose [1] and hierarchal bone vectors such as those used in [2]. My understanding is that openpose learn vector fields between joint keypoints/adjacent limbs, but hierarchical bone vectors are also a way of learning a collection of bone vectors rather as part of a kinematic tree. Is the difference simply that the bone vector methods take the kinematic tree into account, whereas the orientation map methods only care about adjacent segments? Thirdly, I understand that 2d or 3d keypoints are not enough to define orientation but it can be derived from them. Is the derivation of orientation simply how keypoints are connected to adjacent keypoints? For example, the orientation of the elbow is defined relative to its position from the shoulder and wrist? Defined by how the elbow must be rotated to then connect to the wrist and shoulder. Again, any help with these matters would be greatly appreciated. I appreciate that these questions are of an esoteric nature. [1] https://arxiv.org/abs/1812.08008 [2] https://openaccess.thecvf.com/content_CVPR_2020/html/Xu_Deep_Kinematics_Analysis_for_Monocular_3D_Human_Pose_Estimation_CVPR_2020_paper.html submitted by /u/pug____ [link] [comments]  ( 90 min )

The dataset is geared towards computer vision-powered motorcycle helmets or other inventive avenues. Get the dataset here: https://www.kaggle.com/datasets/sadhliroomyprime/motorcycle-night-ride-semantic-segmentation Six standard classes are used which are: Undrivable, Road, Lanemark, My bike, Rider, Movable Movable denotes moving objects e.g. vehicles, people etc., undrivable denoting areas where one cannot ride to. Other classes are self-explanatory inclusive of road, lanemark (inclusive of reflectors), rider, and, of course, the bike itself. We have used SuperAnnotate’s pixel editor as the tool for the semantic segmentation. It works on a raster logic as opposed to a vector one. Exporting include the COCO format. We have prepackaged the dataset inclusive of fused images. Dataset is created by Acme AI Ltd. (www.acmeai.tech) and is #openaccess 😊 😊. Use it to your heart's content. submitted by /u/SithisR [link] [comments]  ( 89 min )

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I'm a MSc student in bioinformatics. What I do is I gather transcriptomic data from many cancer datasets, I conduct some analysis over each dataset sepratly, get important cells and genes as features, and use them in a machine learning model to predict a target variable. The analysis in which I get the cells scores is pretty solid. It is based on the transcriptomic data, and it basically tells me how much is there from each cell type in each sample. In total, I have 38 cell types that I can use as predictive features. For example, CellA gets overall higher scores in responder samples, and a low scores in non-responders. It is informative so I would use it in the model. The aim is to define differences between samples that respond to a therapy (labeled Response) and samples that do not (NoResponse). I tried random forest, gradient boosting machines, XGBoost, logistic regression (with Lasso and Ridge penalties), Kernel SVM, and more. Tree based algorithms are producing AUC = 0.9 in the train set, and AUC = 0.63 in the test set.. something like that. Linear models (logistic regression) is very bad, it has AUC = 0.51 in the test set. I guess they just dont fit my data so I'll use tree based models. I'm using cross validation, I tuned the parameters of each algorithm (like numbers trees, number of nodes...), I tried feature selection, nothing is working. I'm facing an overfitting and it is hurting my brain. What can cause such overfitting? Why is parameter tuning and feature selection not helping at all? could it be that the cells are just not very good predictive features? what do you think please share your thoughts. submitted by /u/ComanConer [link] [comments]  ( 106 min )

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like a starbucks logo based on if i put starbucks give me diff text images?? LMK submitted by /u/Effective_Try_198 [link] [comments]  ( 87 min )

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I am going through Sergey Levine's course on Deep RL and he has the slide below on baselines. As I understand it his derivation wouldn't work because if we use the average reward as in the slide, this quantity is also itself random so it is not ok to just treat it like a constant and therefore there would still be bias (though perhaps not a very large one). Does this make sense? https://preview.redd.it/imgae2882pl91.png?width=4064&format=png&auto=webp&s=0626ad16a24f2bac82fa22cd2c4bc354075f9483 submitted by /u/randomkolmogorov [link] [comments]  ( 99 min )

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Quite interesting that RL finds the optimal result for the MIMO beamforming problem, which is a nonconvex optimization problem and also NP-hard. For the case of N=4, K=4, and Power = 10, Over 100 random samples,MMSE's sum rate is about 8.3. The Branch-reduction-and-bound algorithm computes the optimal sum rate, which is 9.8. The REINFORCEMENT learning algorithm gets 9.756. https://github.com/AI4Finance-Foundation/RLSolver/tree/main/rlsolver/rlsolver_mimo_beamforming submitted by /u/Character-Meat-9176 [link] [comments]  ( 88 min )

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I am getting weird results while training the neural network. I am training the network using the Jupyter. Here, I would train the network, and would save the model on a file if we get better rewards. The thing is that when I train the NN for the first time, I would not get a good result. But, when I re-run the code the next time on the same Jupyter session, it performs extremely well. However, when I re-run the next time, the performance falls. Then, re-running after one or two times on the same session, it again performs extremely well. Also, every time I run the code by restarting the Jupyter session, I would not get the desired output. So, I wonder what is going on? submitted by /u/Icy_Improvement_5527 [link] [comments]  ( 88 min )

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The electronic design automation (EDA) community has been actively exploring machine learning (ML) for very large-scale integrated computer-aided design (VLSI CAD). Many studies explored learning-based techniques for cross-stage prediction tasks in the design flow to achieve faster design convergence. Although building ML models usually requires a large amount of data, most studies can only generate small internal datasets for validation because of the lack of large public datasets. In this essay, we present the first open-source dataset called CircuitNet for ML tasks in VLSI CAD.  ( 2 min )

The surge in interest in Artificial Intelligence (AI) over the past decade has been driven almost exclusively by advances in Artificial Neural Networks (ANNs). While ANNs set state-of-the-art performance for many previously intractable problems, the use of global gradient descent necessitates large datasets and computational resources for training, potentially limiting their scalability for real-world domains. Spiking Neural Networks (SNNs) are an alternative to ANNs that use more brain-like artificial neurons and can use local unsupervised learning to rapidly discover sparse recognizable features in the input data. SNNs, however, struggle with dynamical stability and have failed to match the accuracy of ANNs. Here we show how an SNN can overcome many of the shortcomings that have been identified in the literature, including offering a principled solution to the dynamical "vanishing spike problem", to outperform all existing shallow SNNs and equal the performance of an ANN. It accomplishes this while using unsupervised learning with unlabeled data and only 1/50th of the training epochs (labeled data is used only for a simple linear readout layer). This result makes SNNs a viable new method for fast, accurate, efficient, explainable, and re-deployable machine learning with unlabeled data.  ( 3 min )

Paper: https://arxiv.org/abs/2105.12196 Youtube: https://www.youtube.com/watch?v=KHMwq9pv7mg Abstract: Intelligent behaviour in the physical world exhibits structure at multiple spatial and temporal scales. Although movements are ultimately executed at the level of instantaneous muscle tensions or joint torques, they must be selected to serve goals defined on much longer timescales, and in terms of relations that extend far beyond the body itself, ultimately involving coordination with other agents. Recent research in artificial intelligence has shown the promise of learning-based approaches to the respective problems of complex movement, longer-term planning and multi-agent coordination. However, there is limited research aimed at their integration. We study this problem by training …  ( 107 min )

Dear redditors: I am very fond of your post related to articles that uses poorly machine learning on health related outcomes. But, there is any paper that you consider good, and why? submitted by /u/clbustos [link] [comments]  ( 88 min )

Paper: https://arxiv.org/abs/2209.00588 Github: https://github.com/eloialonso/iris Abstract: Deep reinforcement learning agents are notoriously sample inefficient, which considerably limits their application to real-world problems. Recently, many model-based methods have been designed to address this issue, with learning in the imagination of a world model being one of the most prominent approaches. However, while virtually unlimited interaction with a simulated environment sounds appealing, the world model has to be accurate over extended periods of time. Motivated by the success of Transformers in sequence modeling tasks, we introduce IRIS, a data-efficient agent that learns in a world model composed of a discrete autoencoder and an autoregressive Transformer. With the equivalent of only two hours of gameplay in the Atari 100k benchmark, IRIS achieves a mean human normalized score of 1.046, and outperforms humans on 10 out of 26 games. Our approach sets a new state of the art for methods without lookahead search, and even surpasses MuZero. To foster future research on Transformers and world models for sample-efficient reinforcement learning, we release our codebase at this https URL. https://preview.redd.it/70yubh27sil91.jpg?width=981&format=pjpg&auto=webp&s=0d51b9e6d350d6b16b199b80bf5815f5b338123b https://preview.redd.it/k0wh7g27sil91.jpg?width=965&format=pjpg&auto=webp&s=3a956ce30bae95f3e2217f58d4cc96c66f259b52 https://preview.redd.it/xz3vyf27sil91.jpg?width=1369&format=pjpg&auto=webp&s=dac91c84ddaa35b9738bef709d4adfb6f205ee7a submitted by /u/Singularian2501 [link] [comments]  ( 89 min )

My fiancee's tire blew out last week and she spent 40 minutes searching through reviews tyring to find a decent mechanic, and then another 40 actually calling to get an appointment. She was understandably frustrated throughout this process. She's a medical resident that works a 100 hours a week and has very little time for this kind of bull. During the pandemic, as I imagine is the case with many couples, we've grown quite close. Her rage during this process became my rage. Her suffering, my suffering. And so, as all engineers must, I donned my remote work cape, marched over to my stand-up desk with the sit-down feature, and began to code with more enthusiasm than a thousand labradors. What emerged at the end was an overengineered single-utility AI assistant that helps you find the best-in-class option for any business or restaurant so no one ever has to see their loved ones suffer as I have. Try it out if you're interested and let me know what you think: +1 (213) 577-2447. Right now it can't actually book an appointment, but every great story needs a sequel... ​ https://preview.redd.it/mxm8x36dqil91.png?width=748&format=png&auto=webp&s=c9cebed1bf60e72d96baf02ceadaea4ddc863673 submitted by /u/SudoSharma [link] [comments]  ( 89 min )

How do people think about the tradeoff between specificity (for lack of a better word) of observations and quantity of observations when building models? For an imperfect toy example, suppose we are trying to predict housing prices in 5 different cities across the world, where we have data from each city and a shared feature space. We expect a lot of the same patterns to be useful across cities, but we also suspect each city’s target has a slightly different relationship with the feature space. The two extremes are to (a) include the entire dataset when building one model, or (b) create an individual model for each city. Ideally, we’d like to take advantage of learnings from the entire dataset, while honing in on each particular city’s unique distributions/relationships. I understand tree ensembles (Random Forest, GBDTs) would get at some of this simply by including “City” as an input, but I feel like there could be better approaches. Any thoughts/insights to consider? submitted by /u/Captain___Mutato [link] [comments]  ( 89 min )

https://youtu.be/2ethDz9KnLk Did you know that something as simple as loading a model can execute arbitrary code on your machine? Try the model: https://huggingface.co/ykilcher/totally-harmless-model Get the code: https://github.com/yk/patch-torch-save OUTLINE: 0:00 - Introduction 1:10 - Sponsor: Weights & Biases 3:20 - How Hugging Face models are loaded 5:30 - From PyTorch to pickle 7:10 - Understanding how pickle saves data 13:00 - Executing arbitrary code 15:05 - The final code 17:25 - How can you protect yourself? submitted by /u/ykilcher [link] [comments]  ( 105 min )

tl;dr Open source datasets that force weights to be open sourced as well. Current State Right now we have two major issues. The first is big tech wishes to play model gatekeeper. We see this in yesterday's discussion on a Senior Google AI engineer finding it unacceptable that the stable diffusion weights are publicly available. The second issue is that big tech is attempting to set the precedent that any publicly available copywritten material is fair game for training. You can see that in this OpenAI opinion and Nat Friedman's (CEO Github) tweet here. I am of the opinion that they are doing serious mental gymnastics to justify their flagrant disregard of copyright. The reason for that is that fair use in the US is a 4 prong test. These commercial use cases fail all four. Looking at …  ( 98 min )

I want to do research, but I don't have acess to a lot compute. At max, I can invest ~2000$ in a GPU setup. Which research areas are most fitting for this setting? ( Without considering the individuual prior knowledge, only the required compute) submitted by /u/chipz6174 [link] [comments]  ( 104 min )

For training my machine learning, I would like to download a lot of high qulity pictures from google and istock. How can I download high quality pictures from istoch and google? Thank you!! submitted by /u/Agorian1992 [link] [comments]  ( 88 min )

I have a PyTorch model that I want to analyze its predictions. So far, if I want to know what classes it predicts, how frequent are the predictions, confidence of the predictions, etc., I generally have to write code from scratch to do that. Is there any library/package out there that can help me achieving this? Something like what torchmetrics does for some common metrics that PyTorch does not support out-of-the-box compared to TensorFlow. submitted by /u/AerysSk [link] [comments]  ( 106 min )

Hey guys, I was just reading a couple papers like AutoML-Zero and I read about Google’s Cloud AutoML, and I was wondering what the latest research on automatically generating NNs for various tasks is. Does such a thing even exist yet? I can’t seem to find anything. Obviously there isn’t any AutoML that can say generate a transformer or anything complicated, but is there anything that can, say, generate a good solution for a problem like CIFAR-10/100? submitted by /u/sjames898 [link] [comments]  ( 90 min )

First published in 2013, Deep Q-Networks (DQN) learn to take actions that outperform humans in a suite of Atari games, taking only the pixel values of the game as input. Learning such effective behaviour directly from experience is a remarkable achievement. It’s the first hint at a viable path towards Artificial General Intelligence - the ability of computers to get intelligent across a wide range of tasks, similar or greater than humans are! Part of the reason DQN was such an impressive advance is that Q-learning - the subtype of Reinforcement Learning used - is very hard to train. This blog outlines why it's so hard and how DeepMind cracked it https://blog.delta-academy.xyz/why-deepmind-dqn-hard-to-train submitted by /u/Ok-Craft-9908 [link] [comments]  ( 89 min )

I got laid off recently, and aside from spending time w/ family and casually looking for a new job, I built this creepy, likely illegal, app to remind you someone's name if you forget it. People always say they forget someone's name right away, so I had this gimmicky idea to use Apache OpenNLP and some simple heuristics to recognize human names in detected ambient voice -> text conversations. It's a little janky, but works often, and was fun to make. I'm not sure on the legality of using this w/o prior consent.. but it's a stab at addressing the name problem. Check it out: https://youtu.be/YlSHJylk2Co submitted by /u/GoochCommander [link] [comments]  ( 92 min )

Many places I read, they say that in the end I'll have to rely on online GPUs like Colab and Kaggle for processing and training my Data. Hence I wanted some experienced perspective into it. Confused between buying HP Victus, i7 11th Gen H, GeForce RTX 3060, 16 GB DDR4 RAM, 512 SSD V/s Apple MacBooks M1 pro / M2. submitted by /u/Substantial-Box7478 [link] [comments]  ( 92 min )

Are the ideas of "iterative reasoning" in chain-of-thought prompting (as shown with Google PaLM model) and diffusion model (recursive refinement of images) analogous to recurrent NN? Or they are just not comparable? submitted by /u/Miserable_Coast [link] [comments]  ( 101 min )

Since images generated by a licensed user of Dalle are allowed to be commercialized and the ai is trained on a dataset that includes copyrighted images I could definitely see a large lawsuit looming in the distance for the developers. If you are an artist or represent an artist with a unique art style there would be a vested monetary interest in ensuring that works in their style can’t be easily reproduced without receiving continued compensation. So I could see are large group of designers and artists pushing for it to be illegal to use copyrighted works in the datasets that Ai are trained on, do you think there is legal precedent for or against this? Also which side would you fall on? I’m not super worried that ai is going to replace artist anytime soon since even if anyone can type a sentence to generate art, someone with the technical skill of an artist still is required to make any changes to that art or to make new forms of art not yet in the dataset but I can see the worry that artists would have and why they would think they need to push for the removal of their works from learning datasets. submitted by /u/moopzilla [link] [comments]  ( 104 min )

Saw this paper posted on Twitter earlier: https://arxiv.org/abs/2209.00588 Abstract: DeepRL agents are notoriously sample inefficient, which considerably limits their application to real-world problems. Recently, many model-based methods have been designed to address this issue, with learning in the imagination of a world model being one of the most prominent approaches. However, while virtually unlimited interaction with a simulated environment sounds appealing, the world model has to be accurate over extended periods of time. Motivated by the success of Transformers in sequence modeling tasks, we introduce IRIS, a data-efficient agent that learns in a world model composed of a discrete autoencoder and an autoregressive Transformer. With the equivalent of only two hours of gameplay in the Atari 100k benchmark, IRIS achieves a mean human normalized score of 1.046, and outperforms humans on 10 out of 26 games. Our approach sets a new state of the art for methods without lookahead search, and even surpasses MuZero. To foster future research on Transformers and world models for sample-efficient reinforcement learning, we release our codebase at https://github.com/eloialonso/iris submitted by /u/hardmaru [link] [comments]  ( 106 min )

this video shows you how you can install stable-diffuison on almost any computer regardless of your graphics card and use an easy to navigate website for your creations. It renders slowly but it works. video: https://www.youtube.com/watch?v=iwHfsDTD8U0 github repo: https://github.com/darkhemic/stable-diffusion-cpuonly submitted by /u/Illustrious_Row_9971 [link] [comments]  ( 88 min )

A group of open source hackers forked Stable Diffusion on GitHub and optimized the model to run on Apple's M1 chip, enabling images to be generated in ~ 15 seconds (512x512 pixels, 50 diffusion steps). This is only a magnitude slower than NVIDIA GPUs, if we compare with batch processing capabilities (from my experience, I can get a batch of 10-20 images generated in similar time frame). Link to the article for more information: https://replicate.com/blog/run-stable-diffusion-on-m1-mac Link to GitHub fork: https://github.com/magnusviri/stable-diffusion Update, this fork has been merged back into the main 'fork': https://github.com/lstein/stable-diffusion submitted by /u/hardmaru [link] [comments]  ( 89 min )

These are going to be Grade 8 (~13yo) students who may have never heard of artificial intelligence. After having gone over the biology unit and defining the characteristics of life, I wanted to have a fun lesson about hypotheticals that could challenge what we understand life to be. For example, I'm planning to have them chat with an AI chatbot. It's meant to just be a pretty chill fun lesson so a video/clip that I could show them even showing AI in media/television or something would work. I saw a clip from the video game Detroit: Become Human that featured a robot begging for its life and being executed without remorse. Something dystopian like that could definitely work (although I'd have to vet them for appropriate violence, etc.) but yeah, pretty much anything that might make a Grade 8 go "huh, maybe the definition of living isn't so clear-cut" or at least "huh, I dunno what I'd do in that situation" kinda thing. Thank you for the help! submitted by /u/Pheophyting [link] [comments]  ( 89 min )

I'm not aware of a video player that will denoise/interpolate/upscale using AI instead of simple algorithms. Does such a thing exist? Dark scenes especially are not handled very well by compression algorithms and AI could resolve that. It seems like a waste to be watching TV with a powerful GPU that is idle. submitted by /u/sasksean [link] [comments]  ( 87 min )

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Hey everybody! I work in customer success and I am considering pursuing the MCIT program at Penn to switch careers and become a software engineer. After befriending the engineering team at my company and seeing all the cool stuff they do, I know I want to get into coding so I can actually build something new that I can be proud of. However, because I am a layman with only some webdev experience (html, css, js), I am having trouble separating the wheat from the chaff when it comes to AI and the future of programming. Some people say it will just increase productivity and necessitate more engineers while others claim AI programming will hollow out developer roles. A masters is a big financial investment and I would have to work less while getting it, so I wanted to consult people who actually understand what AI is and is not capable of before seriously commiting more time to my application. Of course, I am talking to people in my life who are involved with programming about this, but I also want to collect some opinions from people who won't "yes man" me. I know no one has a crystal ball, but I would still appreciate some best guesses. Thanks! :) submitted by /u/Jumpy_Ad830 [link] [comments]  ( 92 min )

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Hi guys need a little help on a little project I am making, I am making a chatbot using android studio, but the bot's response will be scripted base on my code. What I need help is how can I implement into android studio the scriot I made for the bot. Any help will be helpful submitted by /u/creative-name123 [link] [comments]  ( 91 min )

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Hi! I'm currently training a custom environment using PPO + GRU. In this environment, I believe it is essential to observe the agent's past observation that is one-hot encoded. Basically, the agent cannot observe its own position (for a few rare occasions). A human could infer its position by recalling to past keys that were pressed. The RGB pixel observation of 84x84 is propagated through nature CNN resulting in 3136 features. The one-hot encoded last action is is fed to a hidden layer of size 128. The visual and the one-hot latent features are concatenated and then fed to a GRU layer. During training, the gradient norm of the one-hot encoder gets really small (2e-3). The gradient norm of the visual encoder is at 0.15. This leads me to two assumptions: (a) The one-hot encoded features are so well represented that no further parameters need to be modified. (b) The policy ignores the one-hot input, because it thinks it is not useful. I'd rather go for assumption b, because the agent does not learn a reasonable policy. Does anybody have an idea on what could help to motivate the architecture to put more attention on the one-hot encodings? An alternative would be to somehow render the last action onto the pixels. But still solving such issue might be interesting to other scenarios. submitted by /u/LilHairdy [link] [comments]  ( 89 min )

This is a guest post by Ramzi Alqrainy, Chief Technology Officer, The Chefz. The Chefz is a Saudi-based online food delivery startup, founded in 2016. At the core of The Chefz’s business model is enabling its customers to order food and sweets from top elite restaurants, bakeries, and chocolate shops. In this post, we explain […]  ( 4 min )

Distributed deep learning model training is becoming increasingly important as data sizes are growing in many industries. Many applications in computer vision and natural language processing now require training of deep learning models, which are growing exponentially in complexity and are often trained with hundreds of terabytes of data. It then becomes important to use […]  ( 13 min )

As a writer, you know the importance of creating high-quality content. Not only does quality content help your website or blog stand out…  ( 12 min )

submitted by /u/Lakshmireddys [link] [comments]  ( 86 min )

Hi, I created a toy dataset for instance segmentation. The grey scaled images were polygon annotated with makesense.ai (coco format). Each image has two instances of the same kind of object: Two instances labeled as \"chromosome\" lightning-flash trained an instance segmentation model on the dataset.: model = InstanceSegmentation( head="mask_rcnn", backbone="resnet18_fpn", num_classes=datamodule.num_classes,pretrained = False, ) and print(datamodule.labels) print(datamodule.num_classes) yields ['background', 'chromosome'] 2 The model prediction is a unique mask: ​ Unique mask (left) Whereas I want a prediction with two masks. Should I need to relabel the images with two labels: chromosome1 and chromosome2 ? For example : Two annotations with different labels. Would it be possible to edit the annotation file without relabeling each image? Thanks for your advices. submitted by /u/jean-pat [link] [comments]  ( 87 min )

submitted by /u/JoshuaDaD [link] [comments]  ( 138 min )

Humans are weird. The question is, do AI training datasets capture the full scope of our weirdness? I decided to see if GPT-3 could successfully predict other human quirks when prompted with a short list of them. Here's what I gave GPT-3 DaVinci to complete: Human things that  ( 4 min )

AI Weirdness: the strange side of machine learning  ( 2 min )

We are assisting at a growing interest in the development of learning architectures with application to digital communication systems. Herein, we consider the detection/decoding problem. We aim at developing an optimal neural architecture for such a task. The definition of the optimal criterion is a fundamental step. We propose to use the mutual information (MI) of the channel input-output signal pair, which yields to the minimization of the a-posteriori information of the transmitted codeword given the communication channel output observation. The computation of the a-posteriori information is a formidable task, and for the majority of channels it is unknown. Therefore, it has to be learned. For such an objective, we propose a novel neural estimator based on a discriminative formulation. This leads to the derivation of the mutual information neural decoder (MIND). The developed neural architecture is capable not only to solve the decoding problem in unknown channels, but also to return an estimate of the average MI achieved with the coding scheme, as well as the decoding error probability. Several numerical results are reported and compared with maximum a-posteriori and maximum likelihood decoding strategies.

Great progress has been achieved in the community of autonomous driving in the past few years. As a safety-critical problem, however, anomaly detection is a huge hurdle towards a large-scale deployment of autonomous vehicles in the real world. While many approaches, such as uncertainty estimation or segmentation-based image resynthesis, are extremely promising, there is more to be explored. Especially inspired by works on anomaly detection based on image resynthesis, we propose a novel approach for anomaly detection through style transfer. We leverage generative models to map an image from its original style domain of road traffic to an arbitrary one and back to generate pixelwise anomaly scores. However, our experiments have proven our hypothesis wrong, and we were unable to produce significant results. Nevertheless, we want to share our findings, so that others can learn from our experiments.

This paper introduces algorithms to select/design kernels in Gaussian process regression/kriging surrogate modeling techniques. We adopt the setting of kernel method solutions in ad hoc functional spaces, namely Reproducing Kernel Hilbert Spaces (RKHS), to solve the problem of approximating a regular target function given observations of it, i.e. supervised learning. A first class of algorithms is kernel flow, which was introduced in the context of classification in machine learning. It can be seen as a cross-validation procedure whereby a "best" kernel is selected such that the loss of accuracy incurred by removing some part of the dataset (typically half of it) is minimized. A second class of algorithms is called spectral kernel ridge regression, and aims at selecting a "best" kernel such that the norm of the function to be approximated is minimal in the associated RKHS. Within Mercer's theorem framework, we obtain an explicit construction of that "best" kernel in terms of the main features of the target function. Both approaches of learning kernels from data are illustrated by numerical examples on synthetic test functions, and on a classical test case in turbulence modeling validation for transonic flows about a two-dimensional airfoil.

Quantum mechanical methods like Density Functional Theory (DFT) are used with great success alongside efficient search algorithms for studying kinetics of reactive systems. However, DFT is prohibitively expensive for large scale exploration. Machine Learning (ML) models have turned out to be excellent emulators of small molecule DFT calculations and could possibly replace DFT in such tasks. For kinetics, success relies primarily on the models capability to accurately predict the Potential Energy Surface (PES) around transition-states and Minimal Energy Paths (MEPs). Previously this has not been possible due to scarcity of relevant data in the literature. In this paper we train state of the art equivariant Graph Neural Network (GNN)-based models on around 10.000 elementary reactions from the Transition1x dataset. We apply the models as potentials for the Nudged Elastic Band (NEB) algorithm and achieve a Mean Average Error (MAE) of 0.13+/-0.03 eV on barrier energies on unseen reactions. We compare the results against equivalent models trained on QM9 and ANI1x. We also compare with and outperform Density Functional based Tight Binding (DFTB) on both accuracy and computational resource. The implication is that ML models, given relevant data, are now at a level where they can be applied for downstream tasks in quantum chemistry transcending prediction of simple molecular features.

In a partially observable Markov decision process (POMDP), an agent typically uses a representation of the past to approximate the underlying MDP. We propose to utilize a frozen Pretrained Language Transformer (PLT) for history representation and compression to improve sample efficiency. To avoid training of the Transformer, we introduce FrozenHopfield, which automatically associates observations with pretrained token embeddings. To form these associations, a modern Hopfield network stores these token embeddings, which are retrieved by queries that are obtained by a random but fixed projection of observations. Our new method, HELM, enables actor-critic network architectures that contain a pretrained language Transformer for history representation as a memory module. Since a representation of the past need not be learned, HELM is much more sample efficient than competitors. On Minigrid and Procgen environments HELM achieves new state-of-the-art results. Our code is available at https://github.com/ml-jku/helm.

Modern multi-layer perceptron (MLP) models have shown competitive results in learning visual representations without self-attention. However, existing MLP models are not good at capturing local details and lack prior knowledge of human body configurations, which limits their modeling power for skeletal representation learning. To address these issues, we propose a simple yet effective graph-reinforced MLP-Like architecture, named GraphMLP, that combines MLPs and graph convolutional networks (GCNs) in a global-local-graphical unified architecture for 3D human pose estimation. GraphMLP incorporates the graph structure of human bodies into an MLP model to meet the domain-specific demand of the 3D human pose, while allowing for both local and global spatial interactions. Furthermore, we propose to flexibly and efficiently extend the GraphMLP to the video domain and show that complex temporal dynamics can be effectively modeled in a simple way with negligible computational cost gains in the sequence length. To the best of our knowledge, this is the first MLP-Like architecture for 3D human pose estimation in a single frame and a video sequence. Extensive experiments show that the proposed GraphMLP achieves state-of-the-art performance on two datasets, i.e., Human3.6M and MPI-INF-3DHP. Our source code will be open-sourced.

Explainable artificial intelligence (XAI) methods lack ground truth. In its place, method developers have relied on axioms to determine desirable properties for their explanations' behavior. For high stakes uses of machine learning that require explainability, it is not sufficient to rely on axioms as the implementation, or its usage, can fail to live up to the ideal. As a result, there exists active research on validating the performance of XAI methods. The need for validation is especially magnified in domains with a reliance on XAI. A procedure frequently used to assess their utility, and to some extent their fidelity, is an ablation study. By perturbing the input variables in rank order of importance, the goal is to assess the sensitivity of the model's performance. Perturbing important variables should correlate with larger decreases in measures of model capability than perturbing less important features. While the intent is clear, the actual implementation details have not been studied rigorously for tabular data. Using five datasets, three XAI methods, four baselines, and three perturbations, we aim to show 1) how varying perturbations and adding simple guardrails can help to avoid potentially flawed conclusions, 2) how treatment of categorical variables is an important consideration in both post-hoc explainability and ablation studies, and 3) how to identify useful baselines for XAI methods and viable perturbations for ablation studies.

In this paper, we propose a differentiable WORLD synthesizer and demonstrate its use in end-to-end audio style transfer tasks such as (singing) voice conversion and the DDSP timbre transfer task. Accordingly, our baseline differentiable synthesizer has no model parameters, yet it yields adequate synthesis quality. We can extend the baseline synthesizer by appending lightweight black-box postnets which apply further processing to the baseline output in order to improve fidelity. An alternative differentiable approach considers extraction of the source excitation spectrum directly, which can improve naturalness albeit for a narrower class of style transfer applications. The acoustic feature parameterization used by our approaches has the added benefit that it naturally disentangles pitch and timbral information so that they can be modeled separately. Moreover, as there exists a robust means of estimating these acoustic features from monophonic audio sources, it allows for parameter loss terms to be added to an end-to-end objective function, which can help convergence and/or further stabilize (adversarial) training.

The thesis advances the field of software security by providing knowledge and automation support for software vulnerability assessment using data-driven approaches. Software vulnerability assessment provides important and multifaceted information to prevent and mitigate dangerous cyber-attacks in the wild. The key contributions include a systematisation of knowledge, along with a suite of novel data-driven techniques and practical recommendations for researchers and practitioners in the area. The thesis results help improve the understanding and inform the practice of assessing ever-increasing vulnerabilities in real-world software systems. This in turn enables more thorough and timely fixing prioritisation and planning of these critical security issues.

The success of machine learning is fueled by the increasing availability of computing power and large training datasets. The training data is used to learn new models or update existing ones, assuming that it is sufficiently representative of the data that will be encountered at test time. This assumption is challenged by the threat of poisoning, an attack that manipulates the training data to compromise the model's performance at test time. Although poisoning has been acknowledged as a relevant threat in industry applications, and a variety of different attacks and defenses have been proposed so far, a complete systematization and critical review of the field is still missing. In this survey, we provide a comprehensive systematization of poisoning attacks and defenses in machine learning, reviewing more than 100 papers published in the field in the last 15 years. We start by categorizing the current threat models and attacks, and then organize existing defenses accordingly. While we focus mostly on computer-vision applications, we argue that our systematization also encompasses state-of-the-art attacks and defenses for other data modalities. Finally, we discuss existing resources for research in poisoning, and shed light on the current limitations and open research questions in this research field.

Machine learning regression methods allow estimation of functions without unrealistic parametric assumptions. Although they can perform exceptionally in prediction error, most lack theoretical convergence rates necessary for semi-parametric efficient estimation (e.g. TMLE, AIPW) of parameters like average treatment effects. The Highly Adaptive Lasso (HAL) is the only regression method proven to converge quickly enough for a meaningfully large class of functions, independent of the dimensionality of the predictors. Unfortunately, HAL is not computationally scalable. In this paper we build upon the theory of HAL to construct the Selectively Adaptive Lasso (SAL), a new algorithm which retains HAL's dimension-free, nonparametric convergence rate but which also scales computationally to massive datasets. To accomplish this, we prove some general theoretical results pertaining to empirical loss minimization in nested Donsker classes. Our resulting algorithm is a form of gradient tree boosting with an adaptive learning rate, which makes it fast and trivial to implement with off-the-shelf software. Finally, we show that our algorithm retains the performance of standard gradient boosting on a diverse group of real-world datasets. SAL makes semi-parametric efficient estimators practically possible and theoretically justifiable in many big data settings.

Self-supervised learning is an emerging machine learning paradigm. Compared to supervised learning which leverages high-quality labeled datasets, self-supervised learning relies on unlabeled datasets to pre-train powerful encoders which can then be treated as feature extractors for various downstream tasks. The huge amount of data and computational resources consumption makes the encoders themselves become the valuable intellectual property of the model owner. Recent research has shown that the machine learning model's copyright is threatened by model stealing attacks, which aim to train a surrogate model to mimic the behavior of a given model. We empirically show that pre-trained encoders are highly vulnerable to model stealing attacks. However, most of the current efforts of copyright protection algorithms such as watermarking concentrate on classifiers. Meanwhile, the intrinsic challenges of pre-trained encoder's copyright protection remain largely unstudied. We fill the gap by proposing SSLGuard, the first watermarking scheme for pre-trained encoders. Given a clean pre-trained encoder, SSLGuard injects a watermark into it and outputs a watermarked version. The shadow training technique is also applied to preserve the watermark under potential model stealing attacks. Our extensive evaluation shows that SSLGuard is effective in watermark injection and verification, and it is robust against model stealing and other watermark removal attacks such as input noising, output perturbing, overwriting, model pruning, and fine-tuning.

We develop an unsupervised probabilistic model for heterogeneous Electronic Health Record (EHR) data. Utilizing a mixture model formulation, our approach directly models sequences of arbitrary length, such as medications and laboratory results. This allows for subgrouping and incorporation of the dynamics underlying heterogeneous data types. The model consists of a layered set of latent variables that encode underlying structure in the data. These variables represent subject subgroups at the top layer, and unobserved states for sequences in the second layer. We train this model on episodic data from subjects receiving medical care in the Kaiser Permanente Northern California integrated healthcare delivery system. The resulting properties of the trained model generate novel insight from these complex and multifaceted data. In addition, we show how the model can be used to analyze sequences that contribute to assessment of mortality likelihood.

Bootstrap is a principled and powerful frequentist statistical tool for uncertainty quantification. Unfortunately, standard bootstrap methods are computationally intensive due to the need of drawing a large i.i.d. bootstrap sample to approximate the ideal bootstrap distribution; this largely hinders their application in large-scale machine learning, especially deep learning problems. In this work, we propose an efficient method to explicitly \emph{optimize} a small set of high quality ``centroid'' points to better approximate the ideal bootstrap distribution. We achieve this by minimizing a simple objective function that is asymptotically equivalent to the Wasserstein distance to the ideal bootstrap distribution. This allows us to provide an accurate estimation of uncertainty with a small number of bootstrap centroids, outperforming the naive i.i.d. sampling approach. Empirically, we show that our method can boost the performance of bootstrap in a variety of applications.

We study the convergence of a random iterative sequence of a family of operators on infinite dimensional Hilbert spaces, inspired by the Stochastic Gradient Descent (SGD) algorithm in the case of the noiseless regression, as studied in [1]. We identify conditions that are strictly broader than previously known for polynomial convergence rate in various norms, and characterize the roles the randomness plays in determining the best multiplicative constants. Additionally, we prove almost sure convergence of the sequence.

Negative control is a strategy for learning the causal relationship between treatment and outcome in the presence of unmeasured confounding. The treatment effect can nonetheless be identified if two auxiliary variables are available: a negative control treatment (which has no effect on the actual outcome), and a negative control outcome (which is not affected by the actual treatment). These auxiliary variables can also be viewed as proxies for a traditional set of control variables, and they bear resemblance to instrumental variables. I propose a family of algorithms based on kernel ridge regression for learning nonparametric treatment effects with negative controls. Examples include dose response curves, dose response curves with distribution shift, and heterogeneous treatment effects. Data may be discrete or continuous, and low, high, or infinite dimensional. I prove uniform consistency and provide finite sample rates of convergence. I estimate the dose response curve of cigarette smoking on infant birth weight adjusting for unobserved confounding due to household income, using a data set of singleton births in the state of Pennsylvania between 1989 and 1991.

The gradient noise of Stochastic Gradient Descent (SGD) is considered to play a key role in its properties (e.g. escaping low potential points and regularization). Past research has indicated that the covariance of the SGD error done via minibatching plays a critical role in determining its regularization and escape from low potential points. It is however not much explored how much the distribution of the error influences the behavior of the algorithm. Motivated by some new research in this area, we prove universality results by showing that noise classes that have the same mean and covariance structure of SGD via minibatching have similar properties. We mainly consider the Multiplicative Stochastic Gradient Descent (M-SGD) algorithm as introduced by Wu et al., which has a much more general noise class than the SGD algorithm done via minibatching. We establish nonasymptotic bounds for the M-SGD algorithm mainly with respect to the Stochastic Differential Equation corresponding to SGD via minibatching. We also show that the M-SGD error is approximately a scaled Gaussian distribution with mean $0$ at any fixed point of the M-SGD algorithm. We also establish bounds for the convergence of the M-SGD algorithm in the strongly convex regime.

We present results on the number of linear regions of the functions that can be represented by artificial feedforward neural networks with maxout units. A rank-k maxout unit is a function computing the maximum of $k$ linear functions. For networks with a single layer of maxout units, the linear regions correspond to the upper vertices of a Minkowski sum of polytopes. We obtain face counting formulas in terms of the intersection posets of tropical hypersurfaces or the number of upper faces of partial Minkowski sums, along with explicit sharp upper bounds for the number of regions for any input dimension, any number of units, and any ranks, in the cases with and without biases. Based on these results we also obtain asymptotically sharp upper bounds for networks with multiple layers.

The deployment of machine learning algorithms on resource-constrained edge devices is an important challenge from both theoretical and applied points of view. In this article, we focus on resource-efficient randomly connected neural networks known as Random Vector Functional Link (RVFL) networks since their simple design and extremely fast training time make them very attractive for solving many applied classification tasks. We propose to represent input features via the density-based encoding known in the area of stochastic computing and use the operations of binding and bundling from the area of hyperdimensional computing for obtaining the activations of the hidden neurons. Using a collection of 121 real-world datasets from the UCI Machine Learning Repository, we empirically show that the proposed approach demonstrates higher average accuracy than the conventional RVFL. We also demonstrate that it is possible to represent the readout matrix using only integers in a limited range with minimal loss in the accuracy. In this case, the proposed approach operates only on small n-bits integers, which results in a computationally efficient architecture. Finally, through hardware Field-Programmable Gate Array (FPGA) implementations, we show that such an approach consumes approximately eleven times less energy than that of the conventional RVFL.

Policy optimization is a fundamental principle for designing reinforcement learning algorithms, and one example is the proximal policy optimization algorithm with a clipped surrogate objective (PPO-Clip), which has been popularly used in deep reinforcement learning due to its simplicity and effectiveness. Despite its superior empirical performance, PPO-Clip has not been justified via theoretical proof up to date. In this paper, we establish the first global convergence rate of PPO-Clip under neural function approximation. We identify the fundamental challenges of analyzing PPO-Clip and address them with the two core ideas: (i) We reinterpret PPO-Clip from the perspective of hinge loss, which connects policy improvement with solving a large-margin classification problem with hinge loss and offers a generalized version of the PPO-Clip objective. (ii) Based on the above viewpoint, we propose a two-step policy improvement scheme, which facilitates the convergence analysis by decoupling policy search from the complex neural policy parameterization with the help of entropic mirror descent and a regression-based policy update scheme. Moreover, our theoretical results provide the first characterization of the effect of the clipping mechanism on the convergence of PPO-Clip. Through experiments, we empirically validate the reinterpretation of PPO-Clip and the generalized objective with various classifiers on various RL benchmark tasks.

To mitigate the effects of undesired biases in models, several approaches propose to pre-process the input dataset to reduce the risks of discrimination by preventing the inference of sensitive attributes. Unfortunately, most of these pre-processing methods lead to the generation a new distribution that is very different from the original one, thus often leading to unrealistic data. As a side effect, this new data distribution implies that existing models need to be re-trained to be able to make accurate predictions. To address this issue, we propose a novel pre-processing method, that we coin as fair mapping, based on the transformation of the distribution of protected groups onto a chosen target one, with additional privacy constraints whose objective is to prevent the inference of sensitive attributes. More precisely, we leverage on the recent works of the Wasserstein GAN and AttGAN frameworks to achieve the optimal transport of data points coupled with a discriminator enforcing the protection against attribute inference. Our proposed approach, preserves the interpretability of data and can be used without defining exactly the sensitive groups. In addition, our approach can be specialized to model existing state-of-the-art approaches, thus proposing a unifying view on these methods. Finally, several experiments on real and synthetic datasets demonstrate that our approach is able to hide the sensitive attributes, while limiting the distortion of the data and improving the fairness on subsequent data analysis tasks.

Together with the improvements in state-of-the-art accuracies of various tasks, deep learning models are getting significantly larger. However, it is extremely difficult to implement these large models because limited GPU memory makes it impossible to fit large models into a single GPU or even a GPU server. Besides, it is highly necessary to reduce the training time for large models. Previous methods like Megatron-LM implemented a 1-Dimensional distributed method to use GPUs to speed up the training. However, these methods have a high communication overhead and a low scaling efficiency on large-scale clusters. To solve these problems, we propose Tesseract, a highly scalable tensor parallelism with a novel design. It increases efficiency by reducing communication overhead and lowers the memory required for each GPU. By introducing the novel dimension into tensor parallelism, Tesseract greatly increases the memory capacity of tensor parallelism. Concretely, this new dimension furthermore increases the degree of tensor parallelism. Compared to previous 1-D and 2-D methods, Tesseract manages to reduce the communication cost on each layer, resulting in speedups of 1.38x and 1.53x respectively with strong scaling. In weak scaling experiments, Tesseract achieves a maximum of 4.0/1.7 times inference speedup and 3.4/1.7 times throughput improvement compared to 1-D/2-D methods, respectively. By introducing Tesseract, we offer a more efficient and scalable way to implement large deep learning models with limited GPU resources.

Classifying Electroencephalogram(EEG) signals helps in understanding Brain-Computer Interface (BCI). EEG signals are vital in studying how the human mind functions. In this paper, we have used an Arithmetic Calculation dataset consisting of Before Calculation Signals (BCS) and During Calculation Signals (DCS). The dataset consisted of 36 participants. In order to understand the functioning of neurons in the brain, we classified BCS vs DCS. For this classification, we extracted various features such as Mutual Information (MI), Phase Locking Value (PLV), and Entropy namely Permutation entropy, Spectral entropy, Singular value decomposition entropy, Approximate entropy, Sample entropy. The classification of these features was done using RNN-based classifiers such as LSTM, BLSTM, ConvLSTM, and CNN-LSTM. The model achieved an accuracy of 99.72% when entropy was used as a feature and ConvLSTM as a classifier.

The fundamental result of Li, Long, and Srinivasan on approximations of set systems has become a key tool across several communities such as learning theory, algorithms, computational geometry, combinatorics and data analysis. The goal of this paper is to give a modular, self-contained, intuitive proof of this result for finite set systems. The only ingredient we assume is the standard Chernoff's concentration bound. This makes the proof accessible to a wider audience, readers not familiar with techniques from statistical learning theory, and makes it possible to be covered in a single self-contained lecture in a geometry, algorithms or combinatorics course.

Several studies have empirically compared in-distribution (ID) and out-of-distribution (OOD) performance of various models. They report frequent positive correlations on benchmarks in computer vision and NLP. Surprisingly, they never observe inverse correlations suggesting necessary trade-offs. This matters to determine whether ID performance can serve as a proxy for OOD generalization. This short paper shows that inverse correlations between ID and OOD performance do happen in real-world benchmarks. They may have been missed in past studies because of a biased selection of models. We show an example of the pattern on the WILDS-Camelyon17 dataset, using models from multiple training epochs and random seeds. Our observations are particularly striking on models trained with a regularizer that diversifies the solutions to the ERM objective. We nuance recommendations and conclusions made in past studies. (1) High OOD performance does sometimes require trading off ID performance. (2) Focusing on ID performance alone may not lead to optimal OOD performance: it can lead to diminishing and eventually negative returns in OOD performance. (3) Our example reminds that empirical studies only chart regimes achievable with existing methods: care is warranted in deriving prescriptive recommendations.

Classic algorithms and machine learning systems like neural networks are both abundant in everyday life. While classic computer science algorithms are suitable for precise execution of exactly defined tasks such as finding the shortest path in a large graph, neural networks allow learning from data to predict the most likely answer in more complex tasks such as image classification, which cannot be reduced to an exact algorithm. To get the best of both worlds, this thesis explores combining both concepts leading to more robust, better performing, more interpretable, more computationally efficient, and more data efficient architectures. The thesis formalizes the idea of algorithmic supervision, which allows a neural network to learn from or in conjunction with an algorithm. When integrating an algorithm into a neural architecture, it is important that the algorithm is differentiable such that the architecture can be trained end-to-end and gradients can be propagated back through the algorithm in a meaningful way. To make algorithms differentiable, this thesis proposes a general method for continuously relaxing algorithms by perturbing variables and approximating the expectation value in closed form, i.e., without sampling. In addition, this thesis proposes differentiable algorithms, such as differentiable sorting networks, differentiable renderers, and differentiable logic gate networks. Finally, this thesis presents alternative training strategies for learning with algorithms.

The goal of supervised representation learning is to construct effective data representations for prediction. Among all the characteristics of an ideal nonparametric representation of high-dimensional complex data, sufficiency, low dimensionality and disentanglement are some of the most essential ones. We propose a deep dimension reduction approach to learning representations with these characteristics. The proposed approach is a nonparametric generalization of the sufficient dimension reduction method. We formulate the ideal representation learning task as that of finding a nonparametric representation that minimizes an objective function characterizing conditional independence and promoting disentanglement at the population level. We then estimate the target representation at the sample level nonparametrically using deep neural networks. We show that the estimated deep nonparametric representation is consistent in the sense that its excess risk converges to zero. Our extensive numerical experiments using simulated and real benchmark data demonstrate that the proposed methods have better performance than several existing dimension reduction methods and the standard deep learning models in the context of classification and regression.

We consider the problem of parameter estimation in slowly varying regression models with sparsity constraints. We formulate the problem as a mixed integer optimization problem and demonstrate that it can be reformulated exactly as a binary convex optimization problem through a novel exact relaxation. The relaxation utilizes a new equality on Moore-Penrose inverses that convexifies the non-convex objective function while coinciding with the original objective on all feasible binary points. This allows us to solve the problem significantly more efficiently and to provable optimality using a cutting plane-type algorithm. We develop a highly optimized implementation of such algorithm, which substantially improves upon the asymptotic computational complexity of a straightforward implementation. We further develop a heuristic method that is guaranteed to produce a feasible solution and, as we empirically illustrate, generates high quality warm-start solutions for the binary optimization problem. We show, on both synthetic and real-world datasets, that the resulting algorithm outperforms competing formulations in comparable times across a variety of metrics including out-of-sample predictive performance, support recovery accuracy, and false positive rate. The algorithm enables us to train models with 10,000s of parameters, is robust to noise, and able to effectively capture the underlying slowly changing support of the data generating process.

Physics-constrained machine learning is emerging as an important topic in the field of machine learning for physics. One of the most significant advantages of incorporating physics constraints into machine learning methods is that the resulting model requires significantly less data to train. By incorporating physical rules into the machine learning formulation itself, the predictions are expected to be physically plausible. Gaussian process (GP) is perhaps one of the most common methods in machine learning for small datasets. In this paper, we investigate the possibility of constraining a GP formulation with monotonicity on three different material datasets, where one experimental and two computational datasets are used. The monotonic GP is compared against the regular GP, where a significant reduction in the posterior variance is observed. The monotonic GP is strictly monotonic in the interpolation regime, but in the extrapolation regime, the monotonic effect starts fading away as one goes beyond the training dataset. Imposing monotonicity on the GP comes at a small accuracy cost, compared to the regular GP. The monotonic GP is perhaps most useful in applications where data is scarce and noisy, and monotonicity is supported by strong physical evidence.

This study presents a multimodal machine learning model to predict ICD-10 diagnostic codes. We developed separate machine learning models that can handle data from different modalities, including unstructured text, semi-structured text and structured tabular data. We further employed an ensemble method to integrate all modality-specific models to generate ICD-10 codes. Key evidence was also extracted to make our prediction more convincing and explainable. We used the Medical Information Mart for Intensive Care III (MIMIC -III) dataset to validate our approach. For ICD code prediction, our best-performing model (micro-F1 = 0.7633, micro-AUC = 0.9541) significantly outperforms other baseline models including TF-IDF (micro-F1 = 0.6721, micro-AUC = 0.7879) and Text-CNN model (micro-F1 = 0.6569, micro-AUC = 0.9235). For interpretability, our approach achieves a Jaccard Similarity Coefficient (JSC) of 0.1806 on text data and 0.3105 on tabular data, where well-trained physicians achieve 0.2780 and 0.5002 respectively.

Recent approaches for modelling dynamics of physical systems with neural networks enforce Lagrangian or Hamiltonian structure to improve prediction and generalization. However, when coordinates are embedded in high-dimensional data such as images, these approaches either lose interpretability or can only be applied to one particular example. We introduce a new unsupervised neural network model that learns Lagrangian dynamics from images, with interpretability that benefits prediction and control. The model infers Lagrangian dynamics on generalized coordinates that are simultaneously learned with a coordinate-aware variational autoencoder (VAE). The VAE is designed to account for the geometry of physical systems composed of multiple rigid bodies in the plane. By inferring interpretable Lagrangian dynamics, the model learns physical system properties, such as kinetic and potential energy, which enables long-term prediction of dynamics in the image space and synthesis of energy-based controllers.

Heterogeneous graph neural networks (HGNNs) have attracted increasing research interest in recent three years. Most existing HGNNs fall into two classes. One class is meta-path-based HGNNs which either require domain knowledge to handcraft meta-paths or consume huge amount of time and memory to automatically construct meta-paths. The other class does not rely on meta-path construction. It takes homogeneous convolutional graph neural networks (Conv-GNNs) as backbones and extend them to heterogeneous graphs by introducing node-type- and edge-type-dependent parameters. Regardless of the meta-path dependency, most existing HGNNs employ shallow Conv-GNNs such as GCN and GAT to aggregate neighborhood information, and may have limited capability to capture information from high-order neighborhood. In this work, we propose two heterogeneous graph tree network models: Heterogeneous Graph Tree Convolutional Network (HetGTCN) and Heterogeneous Graph Tree Attention Network (HetGTAN), which do not rely on meta-paths to encode heterogeneity in both node features and graph structure. Extensive experiments on three real-world heterogeneous graph data demonstrate that the proposed HetGTCN and HetGTAN are efficient and consistently outperform all state-of-the-art HGNN baselines on semi-supervised node classification tasks, and can go deep without compromising performance.

In Federated Learning (FL) of click-through rate (CTR) prediction, users' data is not shared for privacy protection. The learning is performed by training locally on client devices and communicating only model changes to the server. There are two main challenges: (i) the client heterogeneity, making FL algorithms that use the weighted averaging to aggregate model updates from the clients have slow progress and unsatisfactory learning results; and (ii) the difficulty of tuning the server learning rate with trial-and-error methodology due to the big computation time and resources needed for each experiment. To address these challenges, we propose a simple online meta-learning method to learn a strategy of aggregating the model updates, which adaptively weighs the importance of the clients based on their attributes and adjust the step sizes of the update. We perform extensive evaluations on public datasets. Our method significantly outperforms the state-of-the-art in both the speed of convergence and the quality of the final learning results.

The heart of Quantum Federated Learning (QFL) is associated with a distributed learning architecture across several local quantum devices and a more efficient training algorithm for the QFL is expected to minimize the communication overhead among different quantum participants. In this work, we put forth an efficient learning algorithm, namely federated quantum natural gradient descent (FQNGD), applied in a QFL framework which consists of the variational quantum circuit (VQC)-based quantum neural networks (QNN). The FQNGD algorithm admits much fewer training iterations for the QFL model to get converged and it can significantly reduce the total communication cost among local quantum devices. Compared with other federated learning algorithms, our experiments on a handwritten digit classification dataset corroborate the effectiveness of the FQNGD algorithm for the QFL in terms of a faster convergence rate on the training dataset and higher accuracy on the test one.

As its core computation, a self-attention mechanism gauges pairwise correlations across the entire input sequence. Despite favorable performance, calculating pairwise correlations is prohibitively costly. While recent work has shown the benefits of runtime pruning of elements with low attention scores, the quadratic complexity of self-attention mechanisms and their on-chip memory capacity demands are overlooked. This work addresses these constraints by architecting an accelerator, called SPRINT, which leverages the inherent parallelism of ReRAM crossbar arrays to compute attention scores in an approximate manner. Our design prunes the low attention scores using a lightweight analog thresholding circuitry within ReRAM, enabling SPRINT to fetch only a small subset of relevant data to on-chip memory. To mitigate potential negative repercussions for model accuracy, SPRINT re-computes the attention scores for the few fetched data in digital. The combined in-memory pruning and on-chip recompute of the relevant attention scores enables SPRINT to transform quadratic complexity to a merely linear one. In addition, we identify and leverage a dynamic spatial locality between the adjacent attention operations even after pruning, which eliminates costly yet redundant data fetches. We evaluate our proposed technique on a wide range of state-of-the-art transformer models. On average, SPRINT yields 7.5x speedup and 19.6x energy reduction when total 16KB on-chip memory is used, while virtually on par with iso-accuracy of the baseline models (on average 0.36% degradation).

Deep reinforcement learning agents are notoriously sample inefficient, which considerably limits their application to real-world problems. Recently, many model-based methods have been designed to address this issue, with learning in the imagination of a world model being one of the most prominent approaches. However, while virtually unlimited interaction with a simulated environment sounds appealing, the world model has to be accurate over extended periods of time. Motivated by the success of Transformers in sequence modeling tasks, we introduce IRIS, a data-efficient agent that learns in a world model composed of a discrete autoencoder and an autoregressive Transformer. With the equivalent of only two hours of gameplay in the Atari 100k benchmark, IRIS achieves a mean human normalized score of 1.046, and outperforms humans on 10 out of 26 games. Our approach sets a new state of the art for methods without lookahead search, and even surpasses MuZero. To foster future research on Transformers and world models for sample-efficient reinforcement learning, we release our codebase at https://github.com/eloialonso/iris.

Deep neural networks use multiple layers of functions to map an object represented by an input vector progressively to different representations, and with sufficient training, eventually to a single score for each class that is the output of the final decision function. Ideally, in this output space, the objects of different classes achieve maximum separation. Motivated by the need to better understand the inner working of a deep neural network, we analyze the effectiveness of the learned representations in separating the classes from a data complexity perspective. Using a simple complexity measure, a popular benchmarking task, and a well-known architecture design, we show how the data complexity evolves through the network, how it changes during training, and how it is impacted by the network design and the availability of training samples. We discuss the implications of the observations and the potentials for further studies.

The processing of legal texts has been developing as an emerging field in natural language processing (NLP). Legal texts contain unique jargon and complex linguistic attributes in vocabulary, semantics, syntax, and morphology. Therefore, the development of text simplification (TS) methods specific to the legal domain is of paramount importance for facilitating comprehension of legal text by ordinary people and providing inputs to high-level models for mainstream legal NLP applications. While a recent study proposed a rule-based TS method for legal text, learning-based TS in the legal domain has not been considered previously. Here we introduce an unsupervised simplification method for legal texts (USLT). USLT performs domain-specific TS by replacing complex words and splitting long sentences. To this end, USLT detects complex words in a sentence, generates candidates via a masked-transformer model, and selects a candidate for substitution based on a rank score. Afterward, USLT recursively decomposes long sentences into a hierarchy of shorter core and context sentences while preserving semantic meaning. We demonstrate that USLT outperforms state-of-the-art domain-general TS methods in text simplicity while keeping the semantics intact.

Tiny machine learning (TinyML) in IoT systems exploits MCUs as edge devices for data processing. However, traditional TinyML methods can only perform inference, limited to static environments or classes. Real case scenarios usually work in dynamic environments, thus drifting the context where the original neural model is no more suitable. For this reason, pre-trained models reduce accuracy and reliability during their lifetime because the data recorded slowly becomes obsolete or new patterns appear. Continual learning strategies maintain the model up to date, with runtime fine-tuning of the parameters. This paper compares four state-of-the-art algorithms in two real applications: i) gesture recognition based on accelerometer data and ii) image classification. Our results confirm these systems' reliability and the feasibility of deploying them in tiny-memory MCUs, with a drop in the accuracy of a few percentage points with respect to the original models for unconstrained computing platforms.

We introduce an explorative active learning (AL) algorithm based on Gaussian process regression and marginalized graph kernel (GPR-MGK) to explore chemical space with minimum cost. Using high-throughput molecular dynamics simulation to generate data and graph neural network (GNN) to predict, we constructed an active learning molecular simulation framework for thermodynamic property prediction. In specific, targeting 251,728 alkane molecules consisting of 4 to 19 carbon atoms and their liquid physical properties: densities, heat capacities, and vaporization enthalpies, we use the AL algorithm to select the most informative molecules to represent the chemical space. Validation of computational and experimental test sets shows that only 313 (0.124\% of the total) molecules were sufficient to train an accurate GNN model with $\rm R^2 > 0.99$ for computational test sets and $\rm R^2 > 0.94$ for experimental test sets. We highlight two advantages of the presented AL algorithm: compatibility with high-throughput data generation and reliable uncertainty quantification.

A widely-studied deep reinforcement learning (RL) technique known as Prioritized Experience Replay (PER) allows agents to learn from transitions sampled with non-uniform probability proportional to their temporal-difference (TD) error. Although it has been shown that PER is one of the most crucial components for the overall performance of deep RL methods in discrete action domains, many empirical studies indicate that it considerably underperforms actor-critic algorithms in continuous control. We theoretically show that actor networks cannot be effectively trained with transitions that have large TD errors. As a result, the approximate policy gradient computed under the Q-network diverges from the actual gradient computed under the optimal Q-function. Motivated by this, we introduce a novel experience replay sampling framework for actor-critic methods, which also regards issues with stability and recent findings behind the poor empirical performance of PER. The introduced algorithm suggests a new branch of improvements to PER and schedules effective and efficient training for both actor and critic networks. An extensive set of experiments verifies our theoretical claims and demonstrates that the introduced method significantly outperforms the competing approaches and obtains state-of-the-art results over the standard off-policy actor-critic algorithms.

Language models (LMs) are shown to have commonsense knowledge of the physical world, which is fundamental for completing tasks in everyday situations. However, it is still an open question whether LMs have the ability to generate grounded, executable plans for embodied tasks. It is very challenging because LMs do not have an "eye" or "hand" to perceive the realistic environment. In this work, we show the first study on this important research question. We first present a novel problem formulation named G-PlanET, which takes as input a high-level goal and a table of objects in a specific environment. The expected output is a plan consisting of step-by-step instructions for agents to execute. To enable the study of this problem, we establish an evaluation protocol and devise a dedicated metric for assessing the quality of plans. In our extensive experiments, we show that adding flattened tables for encoding environments and using an iterative decoding strategy can both improve the LMs' ability for grounded planning. Our analysis of the results also leads to interesting non-trivial findings.

Equilibrium propagation (EP) is an alternative to backpropagation (BP) that allows the training of deep neural networks with local learning rules. It thus provides a compelling framework for training neuromorphic systems and understanding learning in neurobiology. However, EP requires infinitesimal teaching signals, thereby limiting its applicability in noisy physical systems. Moreover, the algorithm requires separate temporal phases and has not been applied to large-scale problems. Here we address these issues by extending EP to holomorphic networks. We show analytically that this extension naturally leads to exact gradients even for finite-amplitude teaching signals. Importantly, the gradient can be computed as the first Fourier coefficient from finite neuronal activity oscillations in continuous time without requiring separate phases. Further, we demonstrate in numerical simulations that our approach permits robust estimation of gradients in the presence of noise and that deeper models benefit from the finite teaching signals. Finally, we establish the first benchmark for EP on the ImageNet 32x32 dataset and show that it matches the performance of an equivalent network trained with BP. Our work provides analytical insights that enable scaling EP to large-scale problems and establishes a formal framework for how oscillations could support learning in biological and neuromorphic systems.

Signed directed networks are ubiquitous in real-world applications. However, there has been relatively little work proposing spectral graph neural network (GNN) methods for analyzing such networks. Here we introduce a signed directed Laplacian matrix, which we call the magnetic signed Laplacian, as a natural generalization of both the signed Laplacian on signed graphs and the magnetic Laplacian on directed graphs. We then use this matrix to construct a novel spectral GNN architecture and conduct extensive experiments on both node clustering and link prediction tasks. In these experiments, we consider tasks related to signed information, tasks related to directional information, and tasks related to both signed and directional information. We demonstrate that our proposed spectral GNN is effective for incorporating both signed and directional information, and attains leading performance on a wide range of data sets. Additionally, we provide a novel synthetic network model, which we refer to as the signed directed stochastic block model, and a number of novel real-world data sets based on lead-lag relationships in financial time series.

Extracting temporal relationships between pairs of events in texts is a crucial yet challenging problem for natural language understanding. Depending on the distance between the events, models must learn to differently balance information from local and global contexts surrounding the event pair for temporal relation prediction. Learning how to fuse this information has proved challenging for transformer-based language models. Therefore, we present MulCo: Multi-Scale Contrastive Co-Training, a technique for the better fusion of local and global contextualized features. Our model uses a BERT-based language model to encode local context and a Graph Neural Network (GNN) to represent global document-level syntactic and temporal characteristics. Unlike previous state-of-the-art methods, which use simple concatenation on multi-view features or select optimal sentences using sophisticated reinforcement learning approaches, our model co-trains GNN and BERT modules using a multi-scale contrastive learning objective. The GNN and BERT modules learn a synergistic parameterization by contrasting GNN multi-layer multi-hop subgraphs (i.e., global context embeddings) and BERT outputs (i.e., local context embeddings) through end-to-end back-propagation. We empirically demonstrate that MulCo provides improved ability to fuse local and global contexts encoded using BERT and GNN compared to the current state-of-the-art. Our experimental results show that MulCo achieves new state-of-the-art results on several temporal relation extraction datasets.

Given the increase of publications, search for relevant papers becomes tedious. In particular, search across disciplines or schools of thinking is not supported. This is mainly due to the retrieval with keyword queries: technical terms differ in different sciences or at different times. Relevant articles might better be identified by their mathematical problem descriptions. Just looking at the equations in a paper already gives a hint to whether the paper is relevant. Hence, we propose a new approach for retrieval of mathematical expressions based on machine learning. We design an unsupervised representation learning task that combines embedding learning with self-supervised learning. Using graph convolutional neural networks we embed mathematical expression into low-dimensional vector spaces that allow efficient nearest neighbor queries. To train our models, we collect a huge dataset with over 29 million mathematical expressions from over 900,000 publications published on arXiv.org. The math is converted into an XML format, which we view as graph data. Our empirical evaluations involving a new dataset of manually annotated search queries show the benefits of using embedding models for mathematical retrieval. This work was originally published at KDD 2020.

Subgraphs are rich substructures in graphs, and their nodes and edges can be partially observed in real-world tasks. Under partial observation, existing node- or subgraph-level message-passing produces suboptimal representations. In this paper, we formulate a novel task of learning representations of partially observed subgraphs. To solve this problem, we propose Partial Subgraph InfoMax (PSI) framework and generalize existing InfoMax models, including DGI, InfoGraph, MVGRL, and GraphCL, into our framework. These models maximize the mutual information between the partial subgraph's summary and various substructures from nodes to full subgraphs. In addition, we suggest a novel two-stage model with $k$-hop PSI, which reconstructs the representation of the full subgraph and improves its expressiveness from different local-global structures. Under training and evaluation protocols designed for this problem, we conduct experiments on three real-world datasets and demonstrate that PSI models outperform baselines.

As structured data are often insufficient, labels need to be extracted from free text in electronic health records when developing models for clinical information retrieval and decision support systems. One of the most important contextual properties in clinical text is negation, which indicates the absence of findings. We aimed to improve large scale extraction of labels by comparing three methods for negation detection in Dutch clinical notes. We used the Erasmus Medical Center Dutch Clinical Corpus to compare a rule-based method based on ContextD, a biLSTM model using MedCAT and (finetuned) RoBERTa-based models. We found that both the biLSTM and RoBERTa models consistently outperform the rule-based model in terms of F1 score, precision and recall. In addition, we systematically categorized the classification errors for each model, which can be used to further improve model performance in particular applications. Combining the three models naively was not beneficial in terms of performance. We conclude that the biLSTM and RoBERTa-based models in particular are highly accurate accurate in detecting clinical negations, but that ultimately all three approaches can be viable depending on the use case at hand.

Demonstration learning aims to guide the prompt prediction via providing answered demonstrations in the few shot settings. Despite achieving promising results, existing work only concatenates the answered examples as demonstrations to the prompt template (including the raw context) without any additional operation, neglecting the prompt-demonstration dependencies. Besides, prior research found that randomly replacing the labels of demonstrations marginally hurts performance, illustrating that the model could not properly learn the knowledge brought by the demonstrations. Inspired by the human learning process, in this paper, we introduce Imitation DEMOnstration Learning (Imitation-Demo) to strengthen demonstration learning via explicitly imitating human review behaviour, which includes: (1) contrastive learning mechanism to concentrate on the similar demonstrations. (2) demonstration-label re-prediction method to consolidate known knowledge. Experiment results show that our proposed method achieves state-of-the-art performance on 11 out of 14 classification corpora. Further studies also prove that Imitation-Demo strengthen the association between prompt and demonstrations, which could provide the basis for exploring how demonstration learning works.

Current technologies in quantum-based communications bring a new integration of quantum data with classical data for hybrid processing. However, the frameworks of these technologies are restricted to a single classical or quantum task, which limits their flexibility in near-term applications. We propose a quantum reservoir processor to harness quantum dynamics in computational tasks requiring both classical and quantum inputs. This analog processor comprises a network of quantum dots in which quantum data is incident to the network and classical data is encoded via a coherent field exciting the network. We perform a multitasking application of quantum tomography and nonlinear equalization of classical channels. Interestingly, the tomography can be performed in a closed-loop manner via the feedback control of classical data. Therefore, if the classical input comes from a dynamical system, embedding this system in a closed loop enables hybrid processing even if access to the external classical input is interrupted. Finally, we demonstrate preparing quantum depolarizing channels as a novel quantum machine learning technique for quantum data processing.

In this work we introduce an incremental learning framework for Click-Through-Rate (CTR) prediction and demonstrate its effectiveness for Taboola's massive-scale recommendation service. Our approach enables rapid capture of emerging trends through warm-starting from previously deployed models and fine tuning on "fresh" data only. Past knowledge is maintained via a teacher-student paradigm, where the teacher acts as a distillation technique, mitigating the catastrophic forgetting phenomenon. Our incremental learning framework enables significantly faster training and deployment cycles (x12 speedup). We demonstrate a consistent Revenue Per Mille (RPM) lift over multiple traffic segments and a significant CTR increase on newly introduced items.

Social media platforms give rise to an abundance of posts and comments on every topic imaginable. Many of these posts express opinions on various aspects of society, but their unfalsifiable nature makes them ill-suited to fact-checking pipelines. In this work, we aim to distill such posts into a small set of narratives that capture the essential claims related to a given topic. Understanding and visualizing these narratives can facilitate more informed debates on social media. As a first step towards systematically identifying the underlying narratives on social media, we introduce PAPYER, a fine-grained dataset of online comments related to hygiene in public restrooms, which contains a multitude of unfalsifiable claims. We present a human-in-the-loop pipeline that uses a combination of machine and human kernels to discover the prevailing narratives and show that this pipeline outperforms recent large transformer models and state-of-the-art unsupervised topic models.

Using artificial intelligence (AI) to automatically test a game remains a critical challenge for the development of richer and more complex game worlds and for the advancement of AI at large. One of the most promising methods for achieving that long-standing goal is the use of generative AI agents, namely procedural personas, that attempt to imitate particular playing behaviors which are represented as rules, rewards, or human demonstrations. All research efforts for building those generative agents, however, have focused solely on playing behavior which is arguably a narrow perspective of what a player actually does in a game. Motivated by this gap in the existing state of the art, in this paper we extend the notion of behavioral procedural personas to cater for player experience, thus examining generative agents that can both behave and experience their game as humans would. For that purpose, we employ the Go-Explore reinforcement learning paradigm for training human-like procedural personas, and we test our method on behavior and experience demonstrations of more than 100 players of a racing game. Our findings suggest that the generated agents exhibit distinctive play styles and experience responses of the human personas they were designed to imitate. Importantly, it also appears that experience, which is tied to playing behavior, can be a highly informative driver for better behavioral exploration.

Ensembling neural networks is a long-standing technique for improving the generalization error of neural networks by combining networks with orthogonal properties via a committee decision. We show that this technique is an ideal fit for machine learning on medical data: First, ensembles are amenable to parallel and asynchronous learning, thus enabling efficient training of patient-specific component neural networks. Second, building on the idea of minimizing generalization error by selecting uncorrelated patient-specific networks, we show that one can build an ensemble of a few selected patient-specific models that outperforms a single model trained on much larger pooled datasets. Third, the non-iterative ensemble combination step is an optimal low-dimensional entry point to apply output perturbation to guarantee the privacy of the patient-specific networks. We exemplify our framework of differentially private ensembles on the task of early prediction of sepsis, using real-life intensive care unit data labeled by clinical experts.

One of the main methods for semantic interpretation of text is mapping it into a vector in some embedding space. Such vectors can then be used for a variety of text processing tasks. Recently, most embedding spaces are a product of training large language models. One major drawback of this type of representation is its incomprehensibility to humans. Understanding the embedding space is crucial for several important needs, including the need to explain the decision of a system that uses the embedding, the need to debug the embedding method and compare it to alternatives, and the need to detect biases hidden in the model. In this paper, we present a novel method of transforming any embedding space into a comprehensible conceptual space. We first present an algorithm for deriving a conceptual space with dynamic on-demand granularity. We then show a method for transferring any vector in the original incomprehensible space to an understandable vector in the conceptual space. We combine human tests with cross-model tests to show that the conceptualized vectors indeed represent the semantics of the original vectors. We also show how the conceptualized vectors can be used for various tasks including identifying weaknesses in the semantics underlying the original spaces and differences in the semantics of alternative models.

This work provides several fundamental characterizations of the optimal classification function under the demographic parity constraint. In the awareness framework, akin to the classical unconstrained classification case, we show that maximizing accuracy under this fairness constraint is equivalent to solving a corresponding regression problem followed by thresholding at level $1/2$. We extend this result to linear-fractional classification measures (e.g., ${\rm F}$-score, AM measure, balanced accuracy, etc.), highlighting the fundamental role played by the regression problem in this framework. Our results leverage recently developed connection between the demographic parity constraint and the multi-marginal optimal transport formulation. Informally, our result shows that the transition between the unconstrained problems and the fair one is achieved by replacing the conditional expectation of the label by the solution of the fair regression problem. Finally, leveraging our analysis, we demonstrate an equivalence between the awareness and the unawareness setups in the case of two sensitive groups.

ML-as-a-service continues to grow, and so does the need for very strong privacy guarantees. Secure inference has emerged as a potential solution, wherein cryptographic primitives allow inference without revealing users' inputs to a model provider or model's weights to a user. For instance, the model provider could be a diagnostics company that has trained a state-of-the-art DenseNet-121 model for interpreting a chest X-ray and the user could be a patient at a hospital. While secure inference is in principle feasible for this setting, there are no existing techniques that make it practical at scale. The CrypTFlow2 framework provides a potential solution with its ability to automatically and correctly translate clear-text inference to secure inference for arbitrary models. However, the resultant secure inference from CrypTFlow2 is impractically expensive: Almost 3TB of communication is required to interpret a single X-ray on DenseNet-121. In this paper, we address this outstanding challenge of inefficiency of secure inference with three contributions. First, we show that the primary bottlenecks in secure inference are large linear layers which can be optimized with the choice of network backbone and the use of operators developed for efficient clear-text inference. This finding and emphasis deviates from many recent works which focus on optimizing non-linear activation layers when performing secure inference of smaller networks. Second, based on analysis of a bottle-necked convolution layer, we design a X-operator which is a more efficient drop-in replacement. Third, we show that the fast Winograd convolution algorithm further improves efficiency of secure inference. In combination, these three optimizations prove to be highly effective for the problem of X-ray interpretation trained on the CheXpert dataset.

A key challenge of continual reinforcement learning (CRL) in dynamic environments is to promptly adapt the RL agent's behavior as the environment changes over its lifetime, while minimizing the catastrophic forgetting of the learned information. To address this challenge, in this article, we propose DaCoRL, i.e., dynamics-adaptive continual RL. DaCoRL learns a context-conditioned policy using progressive contextualization, which incrementally clusters a stream of stationary tasks in the dynamic environment into a series of contexts and opts for an expandable multihead neural network to approximate the policy. Specifically, we define a set of tasks with similar dynamics as an environmental context and formalize context inference as a procedure of online Bayesian infinite Gaussian mixture clustering on environment features, resorting to online Bayesian inference to infer the posterior distribution over contexts. Under the assumption of a Chinese restaurant process prior, this technique can accurately classify the current task as a previously seen context or instantiate a new context as needed without relying on any external indicator to signal environmental changes in advance. Furthermore, we employ an expandable multihead neural network whose output layer is synchronously expanded with the newly instantiated context, and a knowledge distillation regularization term for retaining the performance on learned tasks. As a general framework that can be coupled with various deep RL algorithms, DaCoRL features consistent superiority over existing methods in terms of the stability, overall performance and generalization ability, as verified by extensive experiments on several robot navigation and MuJoCo locomotion tasks.

Automatic extraction of funding information from academic articles adds significant value to industry and research communities, such as tracking research outcomes by funding organizations, profiling researchers and universities based on the received funding, and supporting open access policies. Two major challenges of identifying and linking funding entities are: (i) sparse graph structure of the Knowledge Base (KB), which makes the commonly used graph-based entity linking approaches suboptimal for the funding domain, (ii) missing entities in KB, which (unlike recent zero-shot approaches) requires marking entity mentions without KB entries as NIL. We propose an entity linking model that can perform NIL prediction and overcome data scarcity issues in a time and data-efficient manner. Our model builds on a transformer-based mention detection and bi-encoder model to perform entity linking. We show that our model outperforms strong existing baselines.

In recent years, the number of machine learning (ML) technologies gaining regulatory approval for healthcare has increased significantly allowing them to be placed on the market. However, the regulatory frameworks applied to them were originally devised for traditional software, which has largely rule-based behaviour, compared to the data-driven and learnt behaviour of ML. As the frameworks are in the process of reformation, there is a need to proactively assure the safety of ML to prevent patient safety being compromised. The Assurance of Machine Learning for use in Autonomous Systems (AMLAS) methodology was developed by the Assuring Autonomy International Programme based on well-established concepts in system safety. This review has appraised the methodology by consulting ML manufacturers to understand if it converges or diverges from their current safety assurance practices, whether there are gaps and limitations in its structure and if it is fit for purpose when applied to the healthcare domain. Through this work we offer the view that there is clear utility for AMLAS as a safety assurance methodology when applied to healthcare machine learning technologies, although development of healthcare specific supplementary guidance would benefit those implementing the methodology.

Supervised machine learning provides state-of-the-art solutions to a wide range of computer vision problems. However, the need for copious labelled training data limits the capabilities of these algorithms in scenarios where such input is scarce or expensive. Self-supervised learning offers a way to lower the need for manually annotated data by pretraining models for a specific domain on unlabelled data. In this approach, labelled data are solely required to fine-tune models for downstream tasks. Medical image segmentation is a field where labelling data requires expert knowledge and collecting large labelled datasets is challenging; therefore, self-supervised learning algorithms promise substantial improvements in this field. Despite this, self-supervised learning algorithms are used rarely to pretrain medical image segmentation networks. In this paper, we elaborate and analyse the effectiveness of supervised and self-supervised pretraining approaches on downstream medical image segmentation, focusing on convergence and data efficiency. We find that self-supervised pretraining on natural images and target-domain-specific images leads to the fastest and most stable downstream convergence. In our experiments on the ACDC cardiac segmentation dataset, this pretraining approach achieves 4-5 times faster fine-tuning convergence compared to an ImageNet pretrained model. We also show that this approach requires less than five epochs of pretraining on domain-specific data to achieve such improvement in the downstream convergence time. Finally, we find that, in low-data scenarios, supervised ImageNet pretraining achieves the best accuracy, requiring less than 100 annotated samples to realise close to minimal error.

Modern approximations to Gaussian processes are suitable for "tall data", with a cost that scales well in the number of observations, but under-performs on ``wide data'', scaling poorly in the number of input features. That is, as the number of input features grows, good predictive performance requires the number of summarising variables, and their associated cost, to grow rapidly. We introduce a kernel that allows the number of summarising variables to grow exponentially with the number of input features, but requires only linear cost in both number of observations and input features. This scaling is achieved through our introduction of the B\'ezier buttress, which allows approximate inference without computing matrix inverses or determinants. We show that our kernel has close similarities to some of the most used kernels in Gaussian process regression, and empirically demonstrate the kernel's ability to scale to both tall and wide datasets.

Computational phenotyping allows for unsupervised discovery of subgroups of patients as well as corresponding co-occurring medical conditions from electronic health records (EHR). Typically, EHR data contains demographic information, diagnoses and laboratory results. Discovering (novel) phenotypes has the potential to be of prognostic and therapeutic value. Providing medical practitioners with transparent and interpretable results is an important requirement and an essential part for advancing precision medicine. Low-rank data approximation methods such as matrix (e.g., non-negative matrix factorization) and tensor decompositions (e.g., CANDECOMP/PARAFAC) have demonstrated that they can provide such transparent and interpretable insights. Recent developments have adapted low-rank data approximation methods by incorporating different constraints and regularizations that facilitate interpretability further. In addition, they offer solutions for common challenges within EHR data such as high dimensionality, data sparsity and incompleteness. Especially extracting temporal phenotypes from longitudinal EHR has received much attention in recent years. In this paper, we provide a comprehensive review of low-rank approximation-based approaches for computational phenotyping. The existing literature is categorized into temporal vs. static phenotyping approaches based on matrix vs. tensor decompositions. Furthermore, we outline different approaches for the validation of phenotypes, i.e., the assessment of clinical significance.

While variance reduction methods have shown great success in solving large scale optimization problems, many of them suffer from accumulated errors and, therefore, should periodically require the full gradient computation. In this paper, we present a single-loop algorithm named SLEDGE (Single-Loop mEthoD for Gradient Estimator) for finite-sum nonconvex optimization, which does not require periodic refresh of the gradient estimator but achieves nearly optimal gradient complexity. Unlike existing methods, SLEDGE has the advantage of versatility; (i) second-order optimality, (ii) exponential convergence in the PL region, and (iii) smaller complexity under less heterogeneity of data. We build an efficient federated learning algorithm by exploiting these favorable properties. We show the first and second-order optimality of the output and also provide analysis under PL conditions. When the local budget is sufficiently large and clients are less (Hessian-)~heterogeneous, the algorithm requires fewer communication rounds then existing methods such as FedAvg, SCAFFOLD, and Mime. The superiority of our method is verified in numerical experiments.

Federated learning (FL) enables participating parties to collaboratively build a global model with boosted utility without disclosing private data information. Appropriate protection mechanisms have to be adopted to fulfill the opposing requirements in preserving \textit{privacy} and maintaining high model \textit{utility}. In addition, it is a mandate for a federated learning system to achieve high \textit{efficiency} in order to enable large-scale model training and deployment. We propose a unified federated learning framework that reconciles horizontal and vertical federated learning. Based on this framework, we formulate and quantify the trade-offs between privacy leakage, utility loss, and efficiency reduction, which leads us to the No-Free-Lunch (NFL) theorem for the federated learning system. NFL indicates that it is unrealistic to expect an FL algorithm to simultaneously provide excellent privacy, utility, and efficiency in certain scenarios. We then analyze the lower bounds for the privacy leakage, utility loss and efficiency reduction for several widely-adopted protection mechanisms including \textit{Randomization}, \textit{Homomorphic Encryption}, \textit{Secret Sharing} and \textit{Compression}. Our analysis could serve as a guide for selecting protection parameters to meet particular requirements.

We present a novel generative method for the creation of city-scale road layouts. While the output of recent methods is limited in both size of the covered area and diversity, our framework produces large traversable graphs of high quality consisting of vertices and edges representing complete street networks covering 400 square kilometers or more. While our framework can process general 2D embedded graphs, we focus on street networks due to the wide availability of training data. Our generative framework consists of a transformer decoder that is used in a sliding window manner to predict a field of indices, with each index encoding a representation of the local neighborhood. The semantics of each index is determined by a dictionary of context vectors. The index field is then input to a decoder to compute the street graph. Using data from OpenStreetMap, we train our system on whole cities and even across large countries such as the US, and finally compare it to the state of the art.

Citrinet is an end-to-end convolutional Connectionist Temporal Classification (CTC) based automatic speech recognition (ASR) model. To capture local and global contextual information, 1D time-channel separable convolutions combined with sub-word encoding and squeeze-and-excitation (SE) are used in Citrinet, making the whole architecture to be as deep as including 23 blocks with 235 convolution layers and 46 linear layers. This pure convolutional and deep architecture makes Critrinet relatively slow at convergence. In this paper, we propose to introduce multi-head attentions together with feed-forward networks in the convolution module in Citrinet blocks while keeping the SE module and residual module unchanged. For speeding up, we remove 8 convolution layers in each attention-enhanced Citrinet block and reduce 23 blocks to 13. Experiments on the Japanese CSJ-500h and Magic-1600h dataset show that the attention-enhanced Citrinet with less layers and blocks and converges faster with lower character error rates than (1) Citrinet with 80\% training time and (2) Conformer with 40\% training time and 29.8\% model size.

Creating a complex work of art like music necessitates profound creativity. With recent advancements in deep learning and powerful models such as transformers, there has been huge progress in automatic music generation. In an accompaniment generation context, creating a coherent drum pattern with apposite fills and improvisations at proper locations in a song is a challenging task even for an experienced drummer. Drum beats tend to follow a repetitive pattern through stanzas with fills or improvisation at section boundaries. In this work, we tackle the task of drum pattern generation conditioned on the accompanying music played by four melodic instruments: Piano, Guitar, Bass, and Strings. We use the transformer sequence to sequence model to generate a basic drum pattern conditioned on the melodic accompaniment to find that improvisation is largely absent, attributed possibly to its expectedly relatively low representation in the training data. We propose a novelty function to capture the extent of improvisation in a bar relative to its neighbors. We train a model to predict improvisation locations from the melodic accompaniment tracks. Finally, we use a novel BERT-inspired in-filling architecture, to learn the structure of both the drums and melody to in-fill elements of improvised music.

Conformer has achieved impressive results in Automatic Speech Recognition (ASR) by leveraging transformer's capturing of content-based global interactions and convolutional neural network's exploiting of local features. In Conformer, two macaron-like feed-forward layers with half-step residual connections sandwich the multi-head self-attention and convolution modules followed by a post layer normalization. We improve Conformer's long-sequence representation ability in two directions, \emph{sparser} and \emph{deeper}. We adapt a sparse self-attention mechanism with $\mathcal{O}(L\text{log}L)$ in time complexity and memory usage. A deep normalization strategy is utilized when performing residual connections to ensure our training of hundred-level Conformer blocks. On the Japanese CSJ-500h dataset, this deep sparse Conformer achieves respectively CERs of 5.52\%, 4.03\% and 4.50\% on the three evaluation sets and 4.16\%, 2.84\% and 3.20\% when ensembling five deep sparse Conformer variants from 12 to 16, 17, 50, and finally 100 encoder layers.

Integration of multimodal information from various sources has been shown to boost the performance of machine learning models and thus has received increased attention in recent years. Often such models use deep modality-specific networks to obtain unimodal features which are combined to obtain "late-fusion" representations. However, these designs run the risk of information loss in the respective unimodal pipelines. On the other hand, "early-fusion" methodologies, which combine features early, suffer from the problems associated with feature heterogeneity and high sample complexity. In this work, we present an iterative representation refinement approach, called Progressive Fusion, which mitigates the issues with late fusion representations. Our model-agnostic technique introduces backward connections that make late stage fused representations available to early layers, improving the expressiveness of the representations at those stages, while retaining the advantages of late fusion designs. We test Progressive Fusion on tasks including affective sentiment detection, multimedia analysis, and time series fusion with different models, demonstrating its versatility. We show that our approach consistently improves performance, for instance attaining a 5% reduction in MSE and 40% improvement in robustness on multimodal time series prediction.

Statistical decision problems are the foundation of statistical machine learning. The simplest problems are binary and multiclass classification and class probability estimation. Central to their definition is the choice of loss function, which is the means by which the quality of a solution is evaluated. In this paper we systematically develop the theory of loss functions for such problems from a novel perspective whose basic ingredients are convex sets with a particular structure. The loss function is defined as the subgradient of the support function of the convex set. It is consequently automatically proper (calibrated for probability estimation). This perspective provides three novel opportunities. It enables the development of a fundamental relationship between losses and (anti)-norms that appears to have not been noticed before. Second, it enables the development of a calculus of losses induced by the calculus of convex sets which allows the interpolation between different losses, and thus is a potential useful design tool for tailoring losses to particular problems. In doing this we build upon, and considerably extend, existing results on M-sums of convex sets. Third, the perspective leads to a natural theory of `polar' (or `inverse') loss functions, which are derived from the polar dual of the convex set defining the loss, and which form a natural universal substitution function for Vovk's aggregating algorithm.

As a significant ingredient regarding health status, data-driven state-of-health (SOH) estimation has become dominant for lithium-ion batteries (LiBs). To handle data discrepancy across batteries, current SOH estimation models engage in transfer learning (TL), which reserves apriori knowledge gained through reusing partial structures of the offline trained model. However, multiple degradation patterns of a complete life cycle of a battery make it challenging to pursue TL. The concept of the stage is introduced to describe the collection of continuous cycles that present a similar degradation pattern. A transferable multi-stage SOH estimation model is proposed to perform TL across batteries in the same stage, consisting of four steps. First, with identified stage information, raw cycling data from the source battery are reconstructed into the phase space with high dimensions, exploring hidden dynamics with limited sensors. Next, domain invariant representation across cycles in each stage is proposed through cycling discrepancy subspace with reconstructed data. Third, considering the unbalanced discharge cycles among different stages, a switching estimation strategy composed of a lightweight model with the long short-term memory network and a powerful model with the proposed temporal capsule network is proposed to boost estimation accuracy. Lastly, an updating scheme compensates for estimation errors when the cycling consistency of target batteries drifts. The proposed method outperforms its competitive algorithms in various transfer tasks for a run-to-failure benchmark with three batteries.

Machine learning models have been deployed in mobile networks to deal with the data from different layers to enable automated network management and intelligence on devices. To overcome high communication cost and severe privacy concerns of centralized machine learning, Federated Learning (FL) has been proposed to achieve distributed machine learning among networked devices. While the computation and communication limitation has been widely studied in FL, the impact of on-device storage on the performance of FL is still not explored. Without an efficient and effective data selection policy to filter the abundant streaming data on devices, classical FL can suffer from much longer model training time (more than $4\times$) and significant inference accuracy reduction (more than $7\%$), observed in our experiments. In this work, we take the first step to consider the online data selection for FL with limited on-device storage. We first define a new data valuation metric for data selection in FL: the projection of local gradient over an on-device data sample onto the global gradient over the data from all devices. We further design \textbf{ODE}, a framework of \textbf{O}nline \textbf{D}ata s\textbf{E}lection for FL, to coordinate networked devices to store valuable data samples collaboratively, with theoretical guarantees for speeding up model convergence and enhancing final model accuracy, simultaneously. Experimental results on one industrial task (mobile network traffic classification) and three public tasks (synthetic task, image classification, human activity recognition) show the remarkable advantages of ODE over the state-of-the-art approaches. Particularly, on the industrial dataset, ODE achieves as high as $2.5\times$ speedup of training time and $6\%$ increase in final inference accuracy, and is robust to various factors in the practical environment.

Statistical power is a measure of the goodness/strength of a hypothesis test. Formally, it is the probability of detecting an effect, if there is a true effect present to detect. Hence, optimizing statistical power as a function of some parameters of a hypothesis test is desirable. However, for most hypothesis tests, the explicit functional form of statistical power as a function of those parameters is unknown but calculating statistical power for a given set of values of those parameters is possible using simulated experiments. These simulated experiments are usually computationally expensive. Hence, developing the entire statistical power manifold using simulations can be very time-consuming. Motivated by this, we propose a novel genetic algorithm-based framework for learning statistical power manifold. For a multiple linear regression $F$-test, we show that the proposed algorithm/framework learns the statistical power manifold much faster as compared to a brute-force approach as the number of queries to the power oracle is significantly reduced. We also show that the quality of learning the manifold improves as the number of iterations increases for the genetic algorithm.

High-performance traffic flow prediction model designing, a core technology of Intelligent Transportation System, is a long-standing but still challenging task for industrial and academic communities. The lack of integration between physical principles and data-driven models is an important reason for limiting the development of this field. In the literature, physics-based methods can usually provide a clear interpretation of the dynamic process of traffic flow systems but are with limited accuracy, while data-driven methods, especially deep learning with black-box structures, can achieve improved performance but can not be fully trusted due to lack of a reasonable physical basis. To bridge the gap between purely data-driven and physics-driven approaches, we propose a physics-guided deep learning model named Spatio-Temporal Differential Equation Network (STDEN), which casts the physical mechanism of traffic flow dynamics into a deep neural network framework. Specifically, we assume the traffic flow on road networks is driven by a latent potential energy field (like water flows are driven by the gravity field), and model the spatio-temporal dynamic process of the potential energy field as a differential equation network. STDEN absorbs both the performance advantage of data-driven models and the interpretability of physics-based models, so is named a physics-guided prediction model. Experiments on three real-world traffic datasets in Beijing show that our model outperforms state-of-the-art baselines by a significant margin. A case study further verifies that STDEN can capture the mechanism of urban traffic and generate accurate predictions with physical meaning. The proposed framework of differential equation network modeling may also cast light on other similar applications.

Sparse coding strategies have been lauded for their parsimonious representations of data that leverage low dimensional structure. However, inference of these codes typically relies on an optimization procedure with poor computational scaling in high-dimensional problems. For example, sparse inference in the representations learned in the high-dimensional intermediary layers of deep neural networks (DNNs) requires an iterative minimization to be performed at each training step. As such, recent, quick methods in variational inference have been proposed to infer sparse codes by learning a distribution over the codes with a DNN. In this work, we propose a new approach to variational sparse coding that allows us to learn sparse distributions by thresholding samples, avoiding the use of problematic relaxations. We first evaluate and analyze our method by training a linear generator, showing that it has superior performance, statistical efficiency, and gradient estimation compared to other sparse distributions. We then compare to a standard variational autoencoder using a DNN generator on the Fashion MNIST and CelebA datasets

The Infinitesimal Jackknife is a general method for estimating variances of parametric models, and more recently also for some ensemble methods. In this paper we extend the Infinitesimal Jackknife to estimate the covariance between any two models. This can be used to quantify uncertainty for combinations of models, or to construct test statistics for comparing different models or ensembles of models fitted using the same training dataset. Specific examples in this paper use boosted combinations of models like random forests and M-estimators. We also investigate its application on neural networks and ensembles of XGBoost models. We illustrate the efficacy of variance estimates through extensive simulations and its application to the Beijing Housing data, and demonstrate the theoretical consistency of the Infinitesimal Jackknife covariance estimate.

2D animation is a common factor in game development, used for characters, effects and background art. It involves work that takes both skill and time, but parts of which are repetitive and tedious. Automated animation approaches exist, but are designed without animators in mind. The focus is heavily on real-life video, which follows strict laws of how objects move, and does not account for the stylistic movement often present in 2D animation. We propose a problem formulation that more closely adheres to the standard workflow of animation. We also demonstrate a model, SketchBetween, which learns to map between keyframes and sketched in-betweens to rendered sprite animations. We demonstrate that our problem formulation provides the required information for the task and that our model outperforms an existing method.

Traditional federated optimization methods perform poorly with heterogeneous data (ie, accuracy reduction), especially for highly skewed data. In this paper, we investigate the label distribution skew in FL, where the distribution of labels varies across clients. First, we investigate the label distribution skew from a statistical view. We demonstrate both theoretically and empirically that previous methods based on softmax cross-entropy are not suitable, which can result in local models heavily overfitting to minority classes and missing classes. Additionally, we theoretically introduce a deviation bound to measure the deviation of the gradient after local update. At last, we propose FedLC (\textbf {Fed} erated learning via\textbf {L} ogits\textbf {C} alibration), which calibrates the logits before softmax cross-entropy according to the probability of occurrence of each class. FedLC applies a fine-grained calibrated cross-entropy loss to local update by adding a pairwise label margin. Extensive experiments on federated datasets and real-world datasets demonstrate that FedLC leads to a more accurate global model and much improved performance. Furthermore, integrating other FL methods into our approach can further enhance the performance of the global model.

I present my recollections of Richard Feynman's mid-1980s interest in artificial intelligence and neural networks, set in the technical context of the physics-related approaches to neural networks of that time. I attempt to evaluate his ideas in the light of the substantial advances in the field since then, and vice versa. There are aspects of Feynman's interests that I think have been largely achieved and others that remain excitingly open, notably in computational science, and potentially including the revival of symbolic methods therein.

Particle filtering is a standard Monte-Carlo approach for a wide range of sequential inference tasks. The key component of a particle filter is a set of particles with importance weights that serve as a proxy of the true posterior distribution of some stochastic process. In this work, we propose continuous latent particle filters, an approach that extends particle filtering to the continuous-time domain. We demonstrate how continuous latent particle filters can be used as a generic plug-in replacement for inference techniques relying on a learned variational posterior. Our experiments with different model families based on latent neural stochastic differential equations demonstrate superior performance of continuous-time particle filtering in inference tasks like likelihood estimation and sequential prediction for a variety of stochastic processes.

This paper investigates the problem of bounding possible output from a counterfactual query given a set of observational data. While various works of literature have described methodologies to generate efficient algorithms that provide an optimal bound for the counterfactual query, all of them assume a finite-horizon causal diagram. This paper aims to extend the previous work by modifying Q-learning algorithm to provide informative bounds of a causal query given an infinite-horizon causal diagram. Through simulations, our algorithms are proven to perform better compared to existing algorithm.

Unsupervised contrastive learning (UCL) is a self-supervised learning technique that aims to learn a useful representation function by pulling positive samples close to each other while pushing negative samples far apart in the embedding space. To improve the performance of UCL, several works introduced hard-negative unsupervised contrastive learning (H-UCL) that aims to select the "hard" negative samples in contrast to a random sampling strategy used in UCL. In another approach, under the assumption that the label information is available, supervised contrastive learning (SCL) has developed recently by extending the UCL to a fully-supervised setting. In this paper, motivated by the effectiveness of hard-negative sampling strategies in H-UCL and the usefulness of label information in SCL, we propose a contrastive learning framework called hard-negative supervised contrastive learning (H-SCL). Our numerical results demonstrate the effectiveness of H-SCL over both SCL and H-UCL on several image datasets. In addition, we theoretically prove that, under certain conditions, the objective function of H-SCL can be bounded by the objective function of H-UCL but not by the objective function of UCL. Thus, minimizing the H-UCL loss can act as a proxy to minimize the H-SCL loss while minimizing UCL loss cannot. As we numerically showed that H-SCL outperforms other contrastive learning methods, our theoretical result (bounding H-SCL loss by H-UCL loss) helps to explain why H-UCL outperforms UCL in practice.

We study a regularized interacting particle method for computing aggregation patterns and near singular solutions of a Keller-Segal (KS) chemotaxis system in two and three space dimensions, then further develop DeepParticle (DP) method to learn and generate solutions under variations of physical parameters. The KS solutions are approximated as empirical measures of particles which self-adapt to the high gradient part of solutions. We utilize the expressiveness of deep neural networks (DNNs) to represent the transform of samples from a given initial (source) distribution to a target distribution at finite time T prior to blowup without assuming invertibility of the transforms. In the training stage, we update the network weights by minimizing a discrete 2-Wasserstein distance between the input and target empirical measures. To reduce computational cost, we develop an iterative divide-and-conquer algorithm to find the optimal transition matrix in the Wasserstein distance. We present numerical results of DP framework for successful learning and generation of KS dynamics in the presence of laminar and chaotic flows. The physical parameter in this work is either the small diffusivity of chemo-attractant or the reciprocal of the flow amplitude in the advection-dominated regime.

Estimation of causal effects is the core objective of many scientific disciplines. However, it remains a challenging task, especially when the effects are estimated from observational data. Recently, several promising machine learning models have been proposed for causal effect estimation. The evaluation of these models has been based on the mean values of the error of the Average Treatment Effect (ATE) as well as of the Precision in Estimation of Heterogeneous Effect (PEHE). In this paper, we propose to complement the evaluation of causal inference models using concrete statistical evidence, including the performance profiles of Dolan and Mor{\'e}, as well as non-parametric and post-hoc statistical tests. The main motivation behind this approach is the elimination of the influence of a small number of instances or simulation on the benchmarking process, which in some cases dominate the results. We use the proposed evaluation methodology to compare several state-of-the-art causal effect estimation models.

We consider a special case of bandit problems, named batched bandits, in which an agent observes batches of responses over a certain time period. Unlike previous work, we consider a more practically relevant batch-centric scenario of batch learning. That is to say, we provide a policy-agnostic regret analysis and demonstrate upper and lower bounds for the regret of a candidate policy. Our main theoretical results show that the impact of batch learning is a multiplicative factor of batch size relative to the regret of online behavior. Primarily, we study two settings of the stochastic linear bandits: bandits with finitely and infinitely many arms. While the regret bounds are the same for both settings, the former setting results hold under milder assumptions. Also, we provide a more robust result for the 2-armed bandit problem as an important insight. Finally, we demonstrate the consistency of theoretical results by conducting empirical experiments and reflect on optimal batch size choice.

In this paper, we present Tetris, a new task of Goal-Oriented Script Completion. Unlike previous work, it considers a more realistic and more general setting, where the input includes not only the goal but also additional user context, including preferences and history. To address the problem using a knowledge-based approach, we introduce Task Concept Graph, an automatically constructed knowledge base from instructional websites. Different from Commonsense Knowledge Base like ConceptNet, the task concept graph schema introduces various types of noun phrases-based nodes specifically for accomplishing a task. To integrate such graphs into script learning, we devise two methods that acquire concepts from the knowledge base as prompts to downstream script completion. On our WikiHow-based dataset, we find that incorporating concepts from the Task Concept Graph consistently improves performance, demonstrating the benefit of Task Concept Graph for this task. Furthermore, the model with gold-standard concepts as prompt outperforms the baseline significantly, further confirming the need for task-specific knowledge in goal-oriented script completion. The dataset, repository, models, and demo will be publicly available to facilitate further research on this new task.

Recent years have seen considerable advances in audio synthesis with deep generative models. However, the state-of-the-art is very difficult to quantify; different studies often use different evaluation methodologies and different metrics when reporting results, making a direct comparison to other systems difficult if not impossible. Furthermore, the perceptual relevance and meaning of the reported metrics in most cases unknown, prohibiting any conclusive insights with respect to practical usability and audio quality. This paper presents a study that investigates state-of-the-art approaches side-by-side with (i) a set of previously proposed objective metrics for audio reconstruction, and with (ii) a listening study. The results indicate that currently used objective metrics are insufficient to describe the perceptual quality of current systems.

Deep Neural Networks (DNNs) have achieved excellent performance in various fields. However, DNNs' vulnerability to Adversarial Examples (AE) hinders their deployments to safety-critical applications. This paper presents a novel AE detection framework, named BEYOND, for trustworthy predictions. BEYOND performs the detection by distinguishing the AE's abnormal relation with its augmented versions, i.e. neighbors, from two prospects: representation similarity and label consistency. An off-the-shelf Self-Supervised Learning (SSL) model is used to extract the representation and predict the label for its highly informative representation capacity compared to supervised learning models. For clean samples, their representations and predictions are closely consistent with their neighbors, whereas those of AEs differ greatly. Furthermore, we explain this observation and show that by leveraging this discrepancy BEYOND can effectively detect AEs. We develop a rigorous justification for the effectiveness of BEYOND. Furthermore, as a plug-and-play model, BEYOND can easily cooperate with the Adversarial Trained Classifier (ATC), achieving the state-of-the-art (SOTA) robustness accuracy. Experimental results show that BEYOND outperforms baselines by a large margin, especially under adaptive attacks. Empowered by the robust relation net built on SSL, we found that BEYOND outperforms baselines in terms of both detection ability and speed. Our code will be publicly available.

The powerful learning ability of deep neural networks enables reinforcement learning agents to learn competent control policies directly from continuous environments. In theory, to achieve stable performance, neural networks assume i.i.d. inputs, which unfortunately does no hold in the general reinforcement learning paradigm where the training data is temporally correlated and non-stationary. This issue may lead to the phenomenon of "catastrophic interference" and the collapse in performance. In this paper, we present IQ, i.e., interference-aware deep Q-learning, to mitigate catastrophic interference in single-task deep reinforcement learning. Specifically, we resort to online clustering to achieve on-the-fly context division, together with a multi-head network and a knowledge distillation regularization term for preserving the policy of learned contexts. Built upon deep Q networks, IQ consistently boosts the stability and performance when compared to existing methods, verified with extensive experiments on classic control and Atari tasks. The code is publicly available at: https://github.com/Sweety-dm/Interference-aware-Deep-Q-learning.

Generative adversarial networks (GANs) have achieved impressive performance in data synthesis and have driven the development of many applications. However, GANs are known to be hard to train due to their bilevel objective, which leads to the problems of convergence, mode collapse, and gradient vanishing. In this paper, we propose a new generative model called the generative adversarial NTK (GA-NTK) that has a single-level objective. The GA-NTK keeps the spirit of adversarial learning (which helps generate plausible data) while avoiding the training difficulties of GANs. This is done by modeling the discriminator as a Gaussian process with a neural tangent kernel (NTK-GP) whose training dynamics can be completely described by a closed-form formula. We analyze the convergence behavior of GA-NTK trained by gradient descent and give some sufficient conditions for convergence. We also conduct extensive experiments to study the advantages and limitations of GA-NTK and propose some techniques that make GA-NTK more practical.

The study of a machine learning problem is in many ways is difficult to separate from the study of the loss function being used. One avenue of inquiry has been to look at these loss functions in terms of their properties as scoring rules via the proper-composite representation, in which predictions are mapped to probability distributions which are then scored via a scoring rule. However, recent research so far has primarily been concerned with analysing the (typically) finite-dimensional conditional risk problem on the output space, leaving aside the larger total risk minimisation. We generalise a number of these results to an infinite dimensional setting and in doing so we are able to exploit the familial resemblance of density and conditional density estimation to provide a simple characterisation of the canonical link.

Very little is known about the cost landscape for parametrized Quantum Circuits (PQCs). Nevertheless, PQCs are employed in Quantum Neural Networks and Variational Quantum Algorithms, which may allow for near-term quantum advantage. Such applications require good optimizers to train PQCs. Recent works have focused on quantum-aware optimizers specifically tailored for PQCs. However, ignorance of the cost landscape could hinder progress towards such optimizers. In this work, we analytically prove two results for PQCs: (1) We find an exponentially large symmetry in PQCs, yielding an exponentially large degeneracy of the minima in the cost landscape. Alternatively, this can be cast as an exponential reduction in the volume of relevant hyperparameter space. (2) We study the resilience of the symmetries under noise, and show that while it is conserved under unital noise, non-unital channels can break these symmetries and lift the degeneracy of minima, leading to multiple new local minima. Based on these results, we introduce an optimization method called Symmetry-based Minima Hopping (SYMH), which exploits the underlying symmetries in PQCs. Our numerical simulations show that SYMH improves the overall optimizer performance in the presence of non-unital noise at a level comparable to current hardware. Overall, this work derives large-scale circuit symmetries from local gate transformations, and uses them to construct a noise-aware optimization method.

Modern AAA video games feature huge game levels and maps which are increasingly hard for level testers to cover exhaustively. As a result, games often ship with catastrophic bugs such as the player falling through the floor or being stuck in walls. We propose an approach specifically targeted at reachability bugs in simulated 3D environments based on the powerful exploration algorithm, Go-Explore, which saves unique checkpoints across the map and then identifies promising ones to explore from. We show that when coupled with simple heuristics derived from the game's navigation mesh, Go-Explore finds challenging bugs and comprehensively explores complex environments without the need for human demonstration or knowledge of the game dynamics. Go-Explore vastly outperforms more complicated baselines including reinforcement learning with intrinsic curiosity in both covering the navigation mesh and number of unique positions across the map discovered. Finally, due to our use of parallel agents, our algorithm can fully cover a vast 1.5km x 1.5km game world within 10 hours on a single machine making it extremely promising for continuous testing suites.

Within the coming decades, artificial general intelligence (AGI) may surpass human capabilities at a wide range of important tasks. This report makes a case for why, without substantial action to prevent it, AGIs will likely use their intelligence to pursue goals which are very undesirable (in other words, misaligned) from a human perspective, with potentially catastrophic consequences. The report aims to cover the key arguments motivating concern about the alignment problem in a way that's as succinct, concrete and technically-grounded as possible. I argue that realistic training processes plausibly lead to the development of misaligned goals in AGIs, in particular because neural networks trained via reinforcement learning will learn to plan towards achieving a range of goals; gain more reward by deceptively pursuing misaligned goals; and generalize in ways which undermine obedience. As in an earlier report from Cotra (2022), I explain my claims with reference to an illustrative AGI training process, then outline possible research directions for addressing different aspects of the problem.

The use of models, even if efficient, must be accompanied by an understanding at all levels of the process that transforms data (upstream and downstream). Thus, needs increase to define the relationships between individual data and the choice that an algorithm could make based on its analysis (e.g. the recommendation of one product or one promotional offer, or an insurance rate representative of the risk). Model users must ensure that models do not discriminate and that it is also possible to explain their results. This paper introduces the importance of model interpretation and tackles the notion of model transparency. Within an insurance context, it specifically illustrates how some tools can be used to enforce the control of actuarial models that can nowadays leverage on machine learning. On a simple example of loss frequency estimation in car insurance, we show the interest of some interpretability methods to adapt explanation to the target audience.

The standard approaches to neural network implementation yield powerful function approximation capabilities but are limited in their abilities to learn meta representations and reason probabilistic uncertainties in their predictions. Gaussian processes, on the other hand, adopt the Bayesian learning scheme to estimate such uncertainties but are constrained by their efficiency and approximation capacity. The Neural Processes Family (NPF) intends to offer the best of both worlds by leveraging neural networks for meta-learning predictive uncertainties. Such potential has brought substantial research activity to the family in recent years. Therefore, a comprehensive survey of NPF models is needed to organize and relate their motivation, methodology, and experiments. This paper intends to address this gap while digging deeper into the formulation, research themes, and applications concerning the family members. We shed light on their potential to bring several recent advances in other deep learning domains under one umbrella. We then provide a rigorous taxonomy of the family and empirically demonstrate their capabilities for modeling data generating functions operating on 1-d, 2-d, and 3-d input domains. We conclude by discussing our perspectives on the promising directions that can fuel the research advances in the field. Code for our experiments will be made available at https://github.com/srvCodes/neural-processes-survey.

A plethora of deep-neural-networks (DNN) based methods were proposed over the past few years to address the challenging ill-posed inverse problem of MRI reconstruction from undersampled "k-space" (Fourier domain) data. However, instability against variations in the acquisition process and the anatomical distribution, indicates a poor generalization of the relevant physical models by the DNN architectures compared to their classical counterparts. The poor generalization effectively precludes DNN applicability for undersampled MRI reconstruction in the clinical setting. We improve the generalization capacity of DNN methods for undersampled MRI reconstruction by introducing a physically-primed DNN architecture and training approach. Our architecture encodes the undersampling mask in addition to the observed data in the model architecture and employs an appropriate training approach that uses data generated with various undersampling masks to encourage the model to generalize the undersampled MRI reconstruction problem. We demonstrated the added-value of our approach through extensive experimentation with the publicly available Fast-MRI dataset. Our physically-primed approach achieved an enhanced generalization capacity which resulted in significantly improved robustness against variations in the acquisition process and in the anatomical distribution, especially in pathological regions, compared to both vanilla DNN methods and DNN trained with undersampling mask augmentation. Trained models and code to replicate our experiments will become available for research purposes upon acceptance.

Like many team sports, basketball involves two groups of players who engage in collaborative and adversarial activities to win a game. Players and teams are executing various complex strategies to gain an advantage over their opponents. Defining, identifying, and analyzing different types of activities is an important task in sports analytics, as it can lead to better strategies and decisions by the players and coaching staff. The objective of this paper is to automatically recognize basketball group activities from tracking data representing locations of players and the ball during a game. We propose a novel deep learning approach for group activity recognition (GAR) in team sports called NETS. To efficiently model the player relations in team sports, we combined a Transformer-based architecture with LSTM embedding, and a team-wise pooling layer to recognize the group activity. Training such a neural network generally requires a large amount of annotated data, which incurs high labeling cost. To address scarcity of manual labels, we generate weak-labels and pretrain the neural network on a self-supervised trajectory prediction task. We used a large tracking data set from 632 NBA games to evaluate our approach. The results show that NETS is capable of learning group activities with high accuracy, and that self- and weak-supervised training in NETS have a positive impact on GAR accuracy.

This paper introduces a dual-based algorithm framework for solving the regularized online resource allocation problems, which have cumulative convex rewards, hard resource constraints, and a non-separable regularizer. Under a strategy of adaptively updating the resource constraints, the proposed framework only requests an approximate solution to the empirical dual problem up to a certain accuracy, and yet delivers an optimal logarithmic regret under a locally strongly convex assumption. Surprisingly, a delicate analysis of dual objective function enables us to eliminate the notorious loglog factor in regret bound. The flexible framework renders renowned and computationally fast algorithms immediately applicable, e.g., dual gradient descent and stochastic gradient descent. A worst-case square-root regret lower bound is established if the resource constraints are not adaptively updated during dual optimization, which underscores the critical role of adaptive dual variable update. Comprehensive numerical experiments and real data application demonstrate the merits of proposed algorithm framework.

Aiming at exploiting the rich information in user behaviour sequences, sequential recommendation has been widely adopted in real-world recommender systems. However, current methods suffer from the following issues: 1) sparsity of user-item interactions, 2) uncertainty of sequential records, 3) long-tail items. In this paper, we propose to incorporate contrastive learning into the framework of Variational AutoEncoders to address these challenges simultaneously. Firstly, we introduce ContrastELBO, a novel training objective that extends the conventional single-view ELBO to two-view case and theoretically builds a connection between VAE and contrastive learning from a two-view perspective. Then we propose Contrastive Variational AutoEncoder (ContrastVAE in short), a two-branched VAE model with contrastive regularization as an embodiment of ContrastELBO for sequential recommendation. We further introduce two simple yet effective augmentation strategies named model augmentation and variational augmentation to create a second view of a sequence and thus making contrastive learning possible. Experiments on four benchmark datasets demonstrate the effectiveness of ContrastVAE and the proposed augmentation methods. Codes are available at https://github.com/YuWang-1024/ContrastVAE

Holistic scene understanding is pivotal for the performance of autonomous machines. In this paper we propose a new end-to-end model for performing semantic segmentation and depth completion jointly. The vast majority of recent approaches have developed semantic segmentation and depth completion as independent tasks. Our approach relies on RGB and sparse depth as inputs to our model and produces a dense depth map and the corresponding semantic segmentation image. It consists of a feature extractor, a depth completion branch, a semantic segmentation branch and a joint branch which further processes semantic and depth information altogether. The experiments done on Virtual KITTI 2 dataset, demonstrate and provide further evidence, that combining both tasks, semantic segmentation and depth completion, in a multi-task network can effectively improve the performance of each task. Code is available at https://github.com/juanb09111/semantic depth.

Data tensors of orders 3 and greater are routinely being generated. These data collections are increasingly huge and growing. They are either tensor fields (e.g., images, videos, geographic data) in which each location of data contains important information or permutation invariant general tensors (e.g., unsupervised latent space learning, graph network analysis, recommendation systems, etc.). Directly accessing such large data tensor collections for information has become increasingly prohibitive. We learn approximate full-rank and compact tensor sketches with decompositive representations providing compact space, time and spectral embeddings of both tensor fields (P-SCT) and general tensors (P-SCT-Permute). All subsequent information querying with high accuracy is performed on the generative sketches. We produce optimal rank-r Tucker decompositions of arbitrary order data tensors by building tensor sketches from a sample-efficient sub-sampling of tensor slices. Our sample efficient policy is learned via an adaptable stochastic Thompson sampling using Dirichlet distributions with conjugate priors.

Reinforcement learning (RL) is a promising optimal control technique for multi-energy management systems. It does not require a model a priori - reducing the upfront and ongoing project-specific engineering effort and is capable of learning better representations of the underlying system dynamics. However, vanilla RL does not provide constraint satisfaction guarantees - resulting in various potentially unsafe interactions within its safety-critical environment. In this paper, we present two novel safe RL methods, namely SafeFallback and GiveSafe, where the safety constraint formulation is decoupled from the RL formulation. These provide hard-constraint, rather than soft- and chance-constraint, satisfaction guarantees both during training a (near) optimal policy (which involves exploratory and exploitative, i.e. greedy, steps) as well as during deployment of any policy (e.g. random agents or offline trained RL agents). This without the need of solving a mathematical program, resulting in less computational power requirements and a more flexible constraint function formulation (no derivative information is required). In a simulated multi-energy systems case study we have shown that both methods start with a significantly higher utility (i.e. useful policy) compared to a vanilla RL benchmark and Optlayer benchmark (94,6% and 82,8% compared to 35,5% and 77,8%) and that the proposed SafeFallback method even can outperform the vanilla RL benchmark (102,9% to 100%). We conclude that both methods are viably safety constraint handling techniques applicable beyond RL, as demonstrated with random policies while still providing hard-constraint guarantees.

Cybersecurity breaches are the common anomalies for distributed cyber-physical systems (CPS). However, the cyber security breach classification is still a difficult problem, even using cutting-edge artificial intelligence (AI) approaches. In this paper, we study the multi-class classification problem in cyber security for attack detection. A challenging multi-node data-censoring case is considered. In such a case, data within each data center/node cannot be shared while the local data is incomplete. Particularly, local nodes contain only a part of the multiple classes. In order to train a global multi-class classifier without sharing the raw data across all nodes, the main result of our study is designing a multi-node multi-class classification ensemble approach. By gathering the estimated parameters of the binary classifiers and data densities from each local node, the missing information for each local node is completed to build the global multi-class classifier. Numerical experiments are given to validate the effectiveness of the proposed approach under the multi-node data-censoring case. Under such a case, we even show the out-performance of the proposed approach over the full-data approach.

We extend the Kearns-Vazirani learning algorithm to be able to handle systems that change over time. We present a new learning algorithm that can reuse and update previously learned behavior, implement it in the LearnLib library, and evaluate it on large examples, to which we make small adjustments between two runs of the algorithm. In these experiments our algorithm significantly outperforms both the classic Kearns-Vazirani learning algorithm and the current state-of-the-art adaptive algorithm.

Long-latency load requests continue to limit the performance of high-performance processors. To increase the latency tolerance of a processor, architects have primarily relied on two key techniques: sophisticated data prefetchers and large on-chip caches. In this work, we show that: 1) even a sophisticated state-of-the-art prefetcher can only predict half of the off-chip load requests on average across a wide range of workloads, and 2) due to the increasing size and complexity of on-chip caches, a large fraction of the latency of an off-chip load request is spent accessing the on-chip cache hierarchy. The goal of this work is to accelerate off-chip load requests by removing the on-chip cache access latency from their critical path. To this end, we propose a new technique called Hermes, whose key idea is to: 1) accurately predict which load requests might go off-chip, and 2) speculatively fetch the data required by the predicted off-chip loads directly from the main memory, while also concurrently accessing the cache hierarchy for such loads. To enable Hermes, we develop a new lightweight, perceptron-based off-chip load prediction technique that learns to identify off-chip load requests using multiple program features (e.g., sequence of program counters). For every load request, the predictor observes a set of program features to predict whether or not the load would go off-chip. If the load is predicted to go off-chip, Hermes issues a speculative request directly to the memory controller once the load's physical address is generated. If the prediction is correct, the load eventually misses the cache hierarchy and waits for the ongoing speculative request to finish, thus hiding the on-chip cache hierarchy access latency from the critical path of the off-chip load. Our evaluation shows that Hermes significantly improves performance of a state-of-the-art baseline. We open-source Hermes.

Biofilms pose significant problems for engineers in diverse fields, such as marine science, bioenergy, and biomedicine, where effective biofilm control is a long-term goal. The adhesion and surface mechanics of biofilms play crucial roles in generating and removing biofilm. Designing customized nano-surfaces with different surface topologies can alter the adhesive properties to remove biofilms more easily and greatly improve long-term biofilm control. To rapidly design such topologies, we employ individual-based modeling and Bayesian optimization to automate the design process and generate different active surfaces for effective biofilm removal. Our framework successfully generated ideal nano-surfaces for biofilm removal through applied shear and vibration. Densely distributed short pillar topography is the optimal geometry to prevent biofilm formation. Under fluidic shearing, the optimal topography is to sparsely distribute tall, slim, pillar-like structures. When subjected to either vertical or lateral vibrations, thick trapezoidal cones are found to be optimal. Optimizing the vibrational loading indicates a small vibration magnitude with relatively low frequencies is more efficient in removing biofilm. Our results provide insights into various engineering fields that require surface-mediated biofilm control. Our framework can also be applied to more general materials design and optimization.

Recurrent Neural Networks (RNNs) are used in applications that learn dependencies in data sequences, such as speech recognition, human activity recognition, and anomaly detection. In recent years, newer RNN variants, such as GRUs and LSTMs, have been used for implementing these applications. As many of these applications are employed in real-time scenarios, accelerating RNN/LSTM/GRU inference is crucial. In this paper, we propose a novel photonic hardware accelerator called RecLight for accelerating simple RNNs, GRUs, and LSTMs. Simulation results indicate that RecLight achieves 37x lower energy-per-bit and 10% better throughput compared to the state-of-the-art.

This paper introduces algorithms to select/design kernels in Gaussian process regression/kriging surrogate modeling techniques. We adopt the setting of kernel method solutions in ad hoc functional spaces, namely Reproducing Kernel Hilbert Spaces (RKHS), to solve the problem of approximating a regular target function given observations of it, i.e. supervised learning. A first class of algorithms is kernel flow, which was introduced in the context of classification in machine learning. It can be seen as a cross-validation procedure whereby a "best" kernel is selected such that the loss of accuracy incurred by removing some part of the dataset (typically half of it) is minimized. A second class of algorithms is called spectral kernel ridge regression, and aims at selecting a "best" kernel such that the norm of the function to be approximated is minimal in the associated RKHS. Within Mercer's theorem framework, we obtain an explicit construction of that "best" kernel in terms of the main features of the target function. Both approaches of learning kernels from data are illustrated by numerical examples on synthetic test functions, and on a classical test case in turbulence modeling validation for transonic flows about a two-dimensional airfoil.

Machine learning offers an exciting opportunity to improve the calibration of nearly all reconstructed objects in high-energy physics detectors. However, machine learning approaches often depend on the spectra of examples used during training, an issue known as prior dependence. This is an undesirable property of a calibration, which needs to be applicable in a variety of environments. The purpose of this paper is to explicitly highlight the prior dependence of some machine learning-based calibration strategies. We demonstrate how some recent proposals for both simulation-based and data-based calibrations inherit properties of the sample used for training, which can result in biases for downstream analyses. In the case of simulation-based calibration, we argue that our recently proposed Gaussian Ansatz approach can avoid some of the pitfalls of prior dependence, whereas prior-independent data-based calibration remains an open problem.

Machine learning regression methods allow estimation of functions without unrealistic parametric assumptions. Although they can perform exceptionally in prediction error, most lack theoretical convergence rates necessary for semi-parametric efficient estimation (e.g. TMLE, AIPW) of parameters like average treatment effects. The Highly Adaptive Lasso (HAL) is the only regression method proven to converge quickly enough for a meaningfully large class of functions, independent of the dimensionality of the predictors. Unfortunately, HAL is not computationally scalable. In this paper we build upon the theory of HAL to construct the Selectively Adaptive Lasso (SAL), a new algorithm which retains HAL's dimension-free, nonparametric convergence rate but which also scales computationally to massive datasets. To accomplish this, we prove some general theoretical results pertaining to empirical loss minimization in nested Donsker classes. Our resulting algorithm is a form of gradient tree boosting with an adaptive learning rate, which makes it fast and trivial to implement with off-the-shelf software. Finally, we show that our algorithm retains the performance of standard gradient boosting on a diverse group of real-world datasets. SAL makes semi-parametric efficient estimators practically possible and theoretically justifiable in many big data settings.

Bootstrap is a principled and powerful frequentist statistical tool for uncertainty quantification. Unfortunately, standard bootstrap methods are computationally intensive due to the need of drawing a large i.i.d. bootstrap sample to approximate the ideal bootstrap distribution; this largely hinders their application in large-scale machine learning, especially deep learning problems. In this work, we propose an efficient method to explicitly \emph{optimize} a small set of high quality ``centroid'' points to better approximate the ideal bootstrap distribution. We achieve this by minimizing a simple objective function that is asymptotically equivalent to the Wasserstein distance to the ideal bootstrap distribution. This allows us to provide an accurate estimation of uncertainty with a small number of bootstrap centroids, outperforming the naive i.i.d. sampling approach. Empirically, we show that our method can boost the performance of bootstrap in a variety of applications.

Negative control is a strategy for learning the causal relationship between treatment and outcome in the presence of unmeasured confounding. The treatment effect can nonetheless be identified if two auxiliary variables are available: a negative control treatment (which has no effect on the actual outcome), and a negative control outcome (which is not affected by the actual treatment). These auxiliary variables can also be viewed as proxies for a traditional set of control variables, and they bear resemblance to instrumental variables. I propose a family of algorithms based on kernel ridge regression for learning nonparametric treatment effects with negative controls. Examples include dose response curves, dose response curves with distribution shift, and heterogeneous treatment effects. Data may be discrete or continuous, and low, high, or infinite dimensional. I prove uniform consistency and provide finite sample rates of convergence. I estimate the dose response curve of cigarette smoking on infant birth weight adjusting for unobserved confounding due to household income, using a data set of singleton births in the state of Pennsylvania between 1989 and 1991.

Sparse coding strategies have been lauded for their parsimonious representations of data that leverage low dimensional structure. However, inference of these codes typically relies on an optimization procedure with poor computational scaling in high-dimensional problems. For example, sparse inference in the representations learned in the high-dimensional intermediary layers of deep neural networks (DNNs) requires an iterative minimization to be performed at each training step. As such, recent, quick methods in variational inference have been proposed to infer sparse codes by learning a distribution over the codes with a DNN. In this work, we propose a new approach to variational sparse coding that allows us to learn sparse distributions by thresholding samples, avoiding the use of problematic relaxations. We first evaluate and analyze our method by training a linear generator, showing that it has superior performance, statistical efficiency, and gradient estimation compared to other sparse distributions. We then compare to a standard variational autoencoder using a DNN generator on the Fashion MNIST and CelebA datasets

We introduce a novel geometry-informed irreversible perturbation that accelerates convergence of the Langevin algorithm for Bayesian computation. It is well documented that there exist perturbations to the Langevin dynamics that preserve its invariant measure while accelerating its convergence. Irreversible perturbations and reversible perturbations (such as Riemannian manifold Langevin dynamics (RMLD)) have separately been shown to improve the performance of Langevin samplers. We consider these two perturbations simultaneously by presenting a novel form of irreversible perturbation for RMLD that is informed by the underlying geometry. Through numerical examples, we show that this new irreversible perturbation can improve estimation performance over irreversible perturbations that do not take the geometry into account. Moreover we demonstrate that irreversible perturbations generally can be implemented in conjunction with the stochastic gradient version of the Langevin algorithm. Lastly, while continuous-time irreversible perturbations cannot impair the performance of a Langevin estimator, the situation can sometimes be more complicated when discretization is considered. To this end, we describe a discrete-time example in which irreversibility increases both the bias and variance of the resulting estimator.

We consider the problem of detecting the presence of a signal in a rank-one spiked Wigner model. For general non-Gaussian noise, assuming that the signal is drawn from the Rademacher prior, we prove that the log likelihood ratio (LR) of the spiked model against the null model converges to a Gaussian when the signal-to-noise ratio is below a certain threshold. The threshold is optimal in the sense that the reliable detection is possible by a transformed principal component analysis (PCA) above it. From the mean and the variance of the limiting Gaussian for the log LR, we compute the limit of the sum of the Type-I error and the Type-II error of the likelihood ratio test. We also prove similar results for a rank-one spiked IID model where the noise is asymmetric but the signal is symmetric.

The deployment of machine learning algorithms on resource-constrained edge devices is an important challenge from both theoretical and applied points of view. In this article, we focus on resource-efficient randomly connected neural networks known as Random Vector Functional Link (RVFL) networks since their simple design and extremely fast training time make them very attractive for solving many applied classification tasks. We propose to represent input features via the density-based encoding known in the area of stochastic computing and use the operations of binding and bundling from the area of hyperdimensional computing for obtaining the activations of the hidden neurons. Using a collection of 121 real-world datasets from the UCI Machine Learning Repository, we empirically show that the proposed approach demonstrates higher average accuracy than the conventional RVFL. We also demonstrate that it is possible to represent the readout matrix using only integers in a limited range with minimal loss in the accuracy. In this case, the proposed approach operates only on small n-bits integers, which results in a computationally efficient architecture. Finally, through hardware Field-Programmable Gate Array (FPGA) implementations, we show that such an approach consumes approximately eleven times less energy than that of the conventional RVFL.

Very little is known about the cost landscape for parametrized Quantum Circuits (PQCs). Nevertheless, PQCs are employed in Quantum Neural Networks and Variational Quantum Algorithms, which may allow for near-term quantum advantage. Such applications require good optimizers to train PQCs. Recent works have focused on quantum-aware optimizers specifically tailored for PQCs. However, ignorance of the cost landscape could hinder progress towards such optimizers. In this work, we analytically prove two results for PQCs: (1) We find an exponentially large symmetry in PQCs, yielding an exponentially large degeneracy of the minima in the cost landscape. Alternatively, this can be cast as an exponential reduction in the volume of relevant hyperparameter space. (2) We study the resilience of the symmetries under noise, and show that while it is conserved under unital noise, non-unital channels can break these symmetries and lift the degeneracy of minima, leading to multiple new local minima. Based on these results, we introduce an optimization method called Symmetry-based Minima Hopping (SYMH), which exploits the underlying symmetries in PQCs. Our numerical simulations show that SYMH improves the overall optimizer performance in the presence of non-unital noise at a level comparable to current hardware. Overall, this work derives large-scale circuit symmetries from local gate transformations, and uses them to construct a noise-aware optimization method.

The goal of supervised representation learning is to construct effective data representations for prediction. Among all the characteristics of an ideal nonparametric representation of high-dimensional complex data, sufficiency, low dimensionality and disentanglement are some of the most essential ones. We propose a deep dimension reduction approach to learning representations with these characteristics. The proposed approach is a nonparametric generalization of the sufficient dimension reduction method. We formulate the ideal representation learning task as that of finding a nonparametric representation that minimizes an objective function characterizing conditional independence and promoting disentanglement at the population level. We then estimate the target representation at the sample level nonparametrically using deep neural networks. We show that the estimated deep nonparametric representation is consistent in the sense that its excess risk converges to zero. Our extensive numerical experiments using simulated and real benchmark data demonstrate that the proposed methods have better performance than several existing dimension reduction methods and the standard deep learning models in the context of classification and regression.

We consider the problem of parameter estimation in slowly varying regression models with sparsity constraints. We formulate the problem as a mixed integer optimization problem and demonstrate that it can be reformulated exactly as a binary convex optimization problem through a novel exact relaxation. The relaxation utilizes a new equality on Moore-Penrose inverses that convexifies the non-convex objective function while coinciding with the original objective on all feasible binary points. This allows us to solve the problem significantly more efficiently and to provable optimality using a cutting plane-type algorithm. We develop a highly optimized implementation of such algorithm, which substantially improves upon the asymptotic computational complexity of a straightforward implementation. We further develop a heuristic method that is guaranteed to produce a feasible solution and, as we empirically illustrate, generates high quality warm-start solutions for the binary optimization problem. We show, on both synthetic and real-world datasets, that the resulting algorithm outperforms competing formulations in comparable times across a variety of metrics including out-of-sample predictive performance, support recovery accuracy, and false positive rate. The algorithm enables us to train models with 10,000s of parameters, is robust to noise, and able to effectively capture the underlying slowly changing support of the data generating process.

In decentralized optimization, nodes of a communication network each possess a local objective function, and communicate using gossip-based methods in order to minimize the average of these per-node functions. While synchronous algorithms are heavily impacted by a few slow nodes or edges in the graph (the \emph{straggler problem}), their asynchronous counterparts are notoriously harder to parametrize. Indeed, their convergence properties for networks with heterogeneous communication and computation delays have defied analysis so far. In this paper, we use a \emph{ continuized} framework to analyze asynchronous algorithms in networks with delays. Our approach yields a precise characterization of convergence time and of its dependency on heterogeneous delays in the network. Our continuized framework benefits from the best of both continuous and discrete worlds: the algorithms it applies to are based on event-driven updates. They are thus essentially discrete and hence readily implementable. Yet their analysis is essentially in continuous time, relying in part on the theory of delayed ODEs. Our algorithms moreover achieve an \emph{asynchronous speedup}: their rate of convergence is controlled by the eigengap of the network graph weighted by local delays, instead of the network-wide worst-case delay as in previous analyses. Our methods thus enjoy improved robustness to stragglers.

Recent approaches for modelling dynamics of physical systems with neural networks enforce Lagrangian or Hamiltonian structure to improve prediction and generalization. However, when coordinates are embedded in high-dimensional data such as images, these approaches either lose interpretability or can only be applied to one particular example. We introduce a new unsupervised neural network model that learns Lagrangian dynamics from images, with interpretability that benefits prediction and control. The model infers Lagrangian dynamics on generalized coordinates that are simultaneously learned with a coordinate-aware variational autoencoder (VAE). The VAE is designed to account for the geometry of physical systems composed of multiple rigid bodies in the plane. By inferring interpretable Lagrangian dynamics, the model learns physical system properties, such as kinetic and potential energy, which enables long-term prediction of dynamics in the image space and synthesis of energy-based controllers.

The fundamental result of Li, Long, and Srinivasan on approximations of set systems has become a key tool across several communities such as learning theory, algorithms, computational geometry, combinatorics and data analysis. The goal of this paper is to give a modular, self-contained, intuitive proof of this result for finite set systems. The only ingredient we assume is the standard Chernoff's concentration bound. This makes the proof accessible to a wider audience, readers not familiar with techniques from statistical learning theory, and makes it possible to be covered in a single self-contained lecture in a geometry, algorithms or combinatorics course.

The gradient noise of Stochastic Gradient Descent (SGD) is considered to play a key role in its properties (e.g. escaping low potential points and regularization). Past research has indicated that the covariance of the SGD error done via minibatching plays a critical role in determining its regularization and escape from low potential points. It is however not much explored how much the distribution of the error influences the behavior of the algorithm. Motivated by some new research in this area, we prove universality results by showing that noise classes that have the same mean and covariance structure of SGD via minibatching have similar properties. We mainly consider the Multiplicative Stochastic Gradient Descent (M-SGD) algorithm as introduced by Wu et al., which has a much more general noise class than the SGD algorithm done via minibatching. We establish nonasymptotic bounds for the M-SGD algorithm mainly with respect to the Stochastic Differential Equation corresponding to SGD via minibatching. We also show that the M-SGD error is approximately a scaled Gaussian distribution with mean $0$ at any fixed point of the M-SGD algorithm. We also establish bounds for the convergence of the M-SGD algorithm in the strongly convex regime.

In a partially observable Markov decision process (POMDP), an agent typically uses a representation of the past to approximate the underlying MDP. We propose to utilize a frozen Pretrained Language Transformer (PLT) for history representation and compression to improve sample efficiency. To avoid training of the Transformer, we introduce FrozenHopfield, which automatically associates observations with pretrained token embeddings. To form these associations, a modern Hopfield network stores these token embeddings, which are retrieved by queries that are obtained by a random but fixed projection of observations. Our new method, HELM, enables actor-critic network architectures that contain a pretrained language Transformer for history representation as a memory module. Since a representation of the past need not be learned, HELM is much more sample efficient than competitors. On Minigrid and Procgen environments HELM achieves new state-of-the-art results. Our code is available at https://github.com/ml-jku/helm.

The use of models, even if efficient, must be accompanied by an understanding at all levels of the process that transforms data (upstream and downstream). Thus, needs increase to define the relationships between individual data and the choice that an algorithm could make based on its analysis (e.g. the recommendation of one product or one promotional offer, or an insurance rate representative of the risk). Model users must ensure that models do not discriminate and that it is also possible to explain their results. This paper introduces the importance of model interpretation and tackles the notion of model transparency. Within an insurance context, it specifically illustrates how some tools can be used to enforce the control of actuarial models that can nowadays leverage on machine learning. On a simple example of loss frequency estimation in car insurance, we show the interest of some interpretability methods to adapt explanation to the target audience.  ( 2 min )

This paper develops a general framework for estimation of high-dimensional conditional factor models via nuclear norm regularization. We establish large sample properties of the estimators, and provide an efficient computing algorithm for finding the estimators as well as a cross validation procedure for choosing the regularization parameter. The general framework allows us to estimate a variety of conditional factor models in a unified way and quickly deliver new asymptotic results. We apply the method to analyze the cross section of individual US stock returns, and find that imposing homogeneity may improve the model's out-of-sample predictability.  ( 2 min )

This study presents a multimodal machine learning model to predict ICD-10 diagnostic codes. We developed separate machine learning models that can handle data from different modalities, including unstructured text, semi-structured text and structured tabular data. We further employed an ensemble method to integrate all modality-specific models to generate ICD-10 codes. Key evidence was also extracted to make our prediction more convincing and explainable. We used the Medical Information Mart for Intensive Care III (MIMIC -III) dataset to validate our approach. For ICD code prediction, our best-performing model (micro-F1 = 0.7633, micro-AUC = 0.9541) significantly outperforms other baseline models including TF-IDF (micro-F1 = 0.6721, micro-AUC = 0.7879) and Text-CNN model (micro-F1 = 0.6569, micro-AUC = 0.9235). For interpretability, our approach achieves a Jaccard Similarity Coefficient (JSC) of 0.1806 on text data and 0.3105 on tabular data, where well-trained physicians achieve 0.2780 and 0.5002 respectively.  ( 3 min )

While variance reduction methods have shown great success in solving large scale optimization problems, many of them suffer from accumulated errors and, therefore, should periodically require the full gradient computation. In this paper, we present a single-loop algorithm named SLEDGE (Single-Loop mEthoD for Gradient Estimator) for finite-sum nonconvex optimization, which does not require periodic refresh of the gradient estimator but achieves nearly optimal gradient complexity. Unlike existing methods, SLEDGE has the advantage of versatility; (i) second-order optimality, (ii) exponential convergence in the PL region, and (iii) smaller complexity under less heterogeneity of data. We build an efficient federated learning algorithm by exploiting these favorable properties. We show the first and second-order optimality of the output and also provide analysis under PL conditions. When the local budget is sufficiently large and clients are less (Hessian-)~heterogeneous, the algorithm requires fewer communication rounds then existing methods such as FedAvg, SCAFFOLD, and Mime. The superiority of our method is verified in numerical experiments.  ( 2 min )

To mitigate the effects of undesired biases in models, several approaches propose to pre-process the input dataset to reduce the risks of discrimination by preventing the inference of sensitive attributes. Unfortunately, most of these pre-processing methods lead to the generation a new distribution that is very different from the original one, thus often leading to unrealistic data. As a side effect, this new data distribution implies that existing models need to be re-trained to be able to make accurate predictions. To address this issue, we propose a novel pre-processing method, that we coin as fair mapping, based on the transformation of the distribution of protected groups onto a chosen target one, with additional privacy constraints whose objective is to prevent the inference of sensitive attributes. More precisely, we leverage on the recent works of the Wasserstein GAN and AttGAN frameworks to achieve the optimal transport of data points coupled with a discriminator enforcing the protection against attribute inference. Our proposed approach, preserves the interpretability of data and can be used without defining exactly the sensitive groups. In addition, our approach can be specialized to model existing state-of-the-art approaches, thus proposing a unifying view on these methods. Finally, several experiments on real and synthetic datasets demonstrate that our approach is able to hide the sensitive attributes, while limiting the distortion of the data and improving the fairness on subsequent data analysis tasks.  ( 3 min )

Signed directed networks are ubiquitous in real-world applications. However, there has been relatively little work proposing spectral graph neural network (GNN) methods for analyzing such networks. Here we introduce a signed directed Laplacian matrix, which we call the magnetic signed Laplacian, as a natural generalization of both the signed Laplacian on signed graphs and the magnetic Laplacian on directed graphs. We then use this matrix to construct a novel spectral GNN architecture and conduct extensive experiments on both node clustering and link prediction tasks. In these experiments, we consider tasks related to signed information, tasks related to directional information, and tasks related to both signed and directional information. We demonstrate that our proposed spectral GNN is effective for incorporating both signed and directional information, and attains leading performance on a wide range of data sets. Additionally, we provide a novel synthetic network model, which we refer to as the signed directed stochastic block model, and a number of novel real-world data sets based on lead-lag relationships in financial time series.  ( 2 min )

In this paper, we describe a graph-based algorithm that uses the features obtained by a self-supervised transformer to detect and segment salient objects in images and videos. With this approach, the image patches that compose an image or video are organised into a fully connected graph, where the edge between each pair of patches is labeled with a similarity score between patches using features learned by the transformer. Detection and segmentation of salient objects is then formulated as a graph-cut problem and solved using the classical Normalized Cut algorithm. Despite the simplicity of this approach, it achieves state-of-the-art results on several common image and video detection and segmentation tasks. For unsupervised object discovery, this approach outperforms the competing approaches by a margin of 6.1%, 5.7%, and 2.6%, respectively, when tested with the VOC07, VOC12, and COCO20K datasets. For the unsupervised saliency detection task in images, this method improves the score for Intersection over Union (IoU) by 4.4%, 5.6% and 5.2%. When tested with the ECSSD, DUTS, and DUT-OMRON datasets, respectively, compared to current state-of-the-art techniques. This method also achieves competitive results for unsupervised video object segmentation tasks with the DAVIS, SegTV2, and FBMS datasets.  ( 3 min )

This work provides several fundamental characterizations of the optimal classification function under the demographic parity constraint. In the awareness framework, akin to the classical unconstrained classification case, we show that maximizing accuracy under this fairness constraint is equivalent to solving a corresponding regression problem followed by thresholding at level $1/2$. We extend this result to linear-fractional classification measures (e.g., ${\rm F}$-score, AM measure, balanced accuracy, etc.), highlighting the fundamental role played by the regression problem in this framework. Our results leverage recently developed connection between the demographic parity constraint and the multi-marginal optimal transport formulation. Informally, our result shows that the transition between the unconstrained problems and the fair one is achieved by replacing the conditional expectation of the label by the solution of the fair regression problem. Finally, leveraging our analysis, we demonstrate an equivalence between the awareness and the unawareness setups in the case of two sensitive groups.  ( 2 min )

As structured data are often insufficient, labels need to be extracted from free text in electronic health records when developing models for clinical information retrieval and decision support systems. One of the most important contextual properties in clinical text is negation, which indicates the absence of findings. We aimed to improve large scale extraction of labels by comparing three methods for negation detection in Dutch clinical notes. We used the Erasmus Medical Center Dutch Clinical Corpus to compare a rule-based method based on ContextD, a biLSTM model using MedCAT and (finetuned) RoBERTa-based models. We found that both the biLSTM and RoBERTa models consistently outperform the rule-based model in terms of F1 score, precision and recall. In addition, we systematically categorized the classification errors for each model, which can be used to further improve model performance in particular applications. Combining the three models naively was not beneficial in terms of performance. We conclude that the biLSTM and RoBERTa-based models in particular are highly accurate accurate in detecting clinical negations, but that ultimately all three approaches can be viable depending on the use case at hand.  ( 3 min )

The study of a machine learning problem is in many ways is difficult to separate from the study of the loss function being used. One avenue of inquiry has been to look at these loss functions in terms of their properties as scoring rules via the proper-composite representation, in which predictions are mapped to probability distributions which are then scored via a scoring rule. However, recent research so far has primarily been concerned with analysing the (typically) finite-dimensional conditional risk problem on the output space, leaving aside the larger total risk minimisation. We generalise a number of these results to an infinite dimensional setting and in doing so we are able to exploit the familial resemblance of density and conditional density estimation to provide a simple characterisation of the canonical link.  ( 2 min )

In many scenarios such as genome-wide association studies where dependences between variables commonly exist, it is often of interest to infer the interaction effects in the model. However, testing pairwise interactions among millions of variables in complex and high-dimensional data suffers from low statistical power and huge computational cost. To address these challenges, we propose a two-stage testing procedure with false discovery rate (FDR) control, which is known as a less conservative multiple-testing correction. Theoretically, the difficulty in the FDR control dues to the data dependence among test statistics in two stages, and the fact that the number of hypothesis tests conducted in the second stage depends on the screening result in the first stage. By using the Cram\'er type moderate deviation technique, we show that our procedure controls FDR at the desired level asymptotically in the generalized linear model (GLM), where the model is allowed to be misspecified. In addition, the asymptotic power of the FDR control procedure is rigorously established. We demonstrate via comprehensive simulation studies that our two-stage procedure is computationally more efficient than the classical BH procedure, with a comparable or improved statistical power. Finally, we apply the proposed method to a bladder cancer data from dbGaP where the scientific goal is to identify genetic susceptibility loci for bladder cancer.  ( 3 min )

Computational phenotyping allows for unsupervised discovery of subgroups of patients as well as corresponding co-occurring medical conditions from electronic health records (EHR). Typically, EHR data contains demographic information, diagnoses and laboratory results. Discovering (novel) phenotypes has the potential to be of prognostic and therapeutic value. Providing medical practitioners with transparent and interpretable results is an important requirement and an essential part for advancing precision medicine. Low-rank data approximation methods such as matrix (e.g., non-negative matrix factorization) and tensor decompositions (e.g., CANDECOMP/PARAFAC) have demonstrated that they can provide such transparent and interpretable insights. Recent developments have adapted low-rank data approximation methods by incorporating different constraints and regularizations that facilitate interpretability further. In addition, they offer solutions for common challenges within EHR data such as high dimensionality, data sparsity and incompleteness. Especially extracting temporal phenotypes from longitudinal EHR has received much attention in recent years. In this paper, we provide a comprehensive review of low-rank approximation-based approaches for computational phenotyping. The existing literature is categorized into temporal vs. static phenotyping approaches based on matrix vs. tensor decompositions. Furthermore, we outline different approaches for the validation of phenotypes, i.e., the assessment of clinical significance.  ( 2 min )

Modern approximations to Gaussian processes are suitable for "tall data", with a cost that scales well in the number of observations, but under-performs on ``wide data'', scaling poorly in the number of input features. That is, as the number of input features grows, good predictive performance requires the number of summarising variables, and their associated cost, to grow rapidly. We introduce a kernel that allows the number of summarising variables to grow exponentially with the number of input features, but requires only linear cost in both number of observations and input features. This scaling is achieved through our introduction of the B\'ezier buttress, which allows approximate inference without computing matrix inverses or determinants. We show that our kernel has close similarities to some of the most used kernels in Gaussian process regression, and empirically demonstrate the kernel's ability to scale to both tall and wide datasets.  ( 2 min )

Estimation of causal effects is the core objective of many scientific disciplines. However, it remains a challenging task, especially when the effects are estimated from observational data. Recently, several promising machine learning models have been proposed for causal effect estimation. The evaluation of these models has been based on the mean values of the error of the Average Treatment Effect (ATE) as well as of the Precision in Estimation of Heterogeneous Effect (PEHE). In this paper, we propose to complement the evaluation of causal inference models using concrete statistical evidence, including the performance profiles of Dolan and Mor{\'e}, as well as non-parametric and post-hoc statistical tests. The main motivation behind this approach is the elimination of the influence of a small number of instances or simulation on the benchmarking process, which in some cases dominate the results. We use the proposed evaluation methodology to compare several state-of-the-art causal effect estimation models.  ( 2 min )

Kernel-based tests provide a simple yet effective framework that use the theory of reproducing kernel Hilbert spaces to design non-parametric testing procedures. In this paper we propose new theoretical tools that can be used to study the asymptotic behaviour of kernel-based tests in several data scenarios, and in many different testing problems. Unlike current approaches, our methods avoid using lengthy $U$ and $V$ statistics expansions and limit theorems, that commonly appear in the literature, and works directly with random functionals on Hilbert spaces. Therefore, our framework leads to a much simpler and clean analysis of kernel tests, only requiring mild regularity conditions. Furthermore, we show that, in general, our analysis cannot be improved by proving that the regularity conditions required by our methods are both sufficient and necessary. To illustrate the effectiveness of our approach we present a new kernel-test for the conditional independence testing problem, as well as new analyses for already known kernel-based tests.  ( 2 min )

Statistical decision problems are the foundation of statistical machine learning. The simplest problems are binary and multiclass classification and class probability estimation. Central to their definition is the choice of loss function, which is the means by which the quality of a solution is evaluated. In this paper we systematically develop the theory of loss functions for such problems from a novel perspective whose basic ingredients are convex sets with a particular structure. The loss function is defined as the subgradient of the support function of the convex set. It is consequently automatically proper (calibrated for probability estimation). This perspective provides three novel opportunities. It enables the development of a fundamental relationship between losses and (anti)-norms that appears to have not been noticed before. Second, it enables the development of a calculus of losses induced by the calculus of convex sets which allows the interpolation between different losses, and thus is a potential useful design tool for tailoring losses to particular problems. In doing this we build upon, and considerably extend, existing results on M-sums of convex sets. Third, the perspective leads to a natural theory of `polar' (or `inverse') loss functions, which are derived from the polar dual of the convex set defining the loss, and which form a natural universal substitution function for Vovk's aggregating algorithm.  ( 3 min )

The Infinitesimal Jackknife is a general method for estimating variances of parametric models, and more recently also for some ensemble methods. In this paper we extend the Infinitesimal Jackknife to estimate the covariance between any two models. This can be used to quantify uncertainty for combinations of models, or to construct test statistics for comparing different models or ensembles of models fitted using the same training dataset. Specific examples in this paper use boosted combinations of models like random forests and M-estimators. We also investigate its application on neural networks and ensembles of XGBoost models. We illustrate the efficacy of variance estimates through extensive simulations and its application to the Beijing Housing data, and demonstrate the theoretical consistency of the Infinitesimal Jackknife covariance estimate.  ( 2 min )

Cybersecurity breaches are the common anomalies for distributed cyber-physical systems (CPS). However, the cyber security breach classification is still a difficult problem, even using cutting-edge artificial intelligence (AI) approaches. In this paper, we study the multi-class classification problem in cyber security for attack detection. A challenging multi-node data-censoring case is considered. In such a case, data within each data center/node cannot be shared while the local data is incomplete. Particularly, local nodes contain only a part of the multiple classes. In order to train a global multi-class classifier without sharing the raw data across all nodes, the main result of our study is designing a multi-node multi-class classification ensemble approach. By gathering the estimated parameters of the binary classifiers and data densities from each local node, the missing information for each local node is completed to build the global multi-class classifier. Numerical experiments are given to validate the effectiveness of the proposed approach under the multi-node data-censoring case. Under such a case, we even show the out-performance of the proposed approach over the full-data approach.  ( 3 min )

Here’s a cute little poem: I wish I knew The root of two. Oh charmed was he To know root three. So we now strive To find root five. The beginning of each stanza is a mnemonic for the number mentioned in the following line. √ 2 = 1.414 √ 3 = 1.732 √ 5 […] Square root mnemonics first appeared on John D. Cook.  ( 4 min )

Hi, this talk looks like another good example of how we can help prevent climate change. It looks like there are 25 other amazing talks too at PyBay2022, happening in-person in San Francisco AND ONLINE, NEXT SATURDAY Sept 10. https://pybay.com/talklist/ submitted by /u/g_law [link] [comments]  ( 106 min )

What do you all think? Is the solution of keeping it all for internal use, like Imagen, or having a controlled API like Dall-E 2 a better solution? Source: https://twitter.com/negar_rz/status/1565089741808500736 submitted by /u/wei_jok [link] [comments]  ( 94 min )

submitted by /u/Ok-Psychology-7318 [link] [comments]  ( 88 min )

Hello. I am new in this community. I have been learning Python for six months. I want to learn the basics of machine learning and work in this field. Which resources I can follow such as books, courses? submitted by /u/Successful-Ad-1522 [link] [comments]  ( 88 min )

Hello, Currently working on a classification problem where we are predicting whether an event will happen for an imbalanced target variable. We are using the F1 score as the metric for evaluation. If I wanted to conduct an A/B test between two different models, how would we actually conduct this test? Are there any recommended resources I could read to understand this better? submitted by /u/martin1285 [link] [comments]  ( 89 min )

I started trying to implement and read in detail some DL papers. I was reading the paper "Deep Image Matting" and found it quite insightful. I was wondering if you guys know papers that are worth reading/re-implementing because of how well they are written and the information they contain? submitted by /u/jthat92 [link] [comments]  ( 89 min )

Hey folks! I am just overwhelmed that my AI project was selected by Arm for their upcoming AI Tech Talk. I will present my solution for farmers that helps them avoid fake poor-quality agrochemicals on Sep 20th, at 8:00 AM PT. This is my first webinar of such scale and I would appreciate if you support my project by joining me: https://armltd.zoom.us/webinar/register/4016582497950/WN_fJE_6UT_Q1GCfygq8Ll4tw Hope to see you! submitted by /u/wasteguru [link] [comments]  ( 89 min )

Excited to share that my Hugging Face colleague Matthijs Hollemans has built a nifty library that lets you convert models like BERT, GPT-2 and ViT to Apple's Core ML format with a *single line of code* 🤯 https://preview.redd.it/iaerro3bw8l91.png?width=3080&format=png&auto=webp&s=cb39dd7782c304287af492bb22af5f3c5f164799 Core ML is Apple's software library for fast on-device model inference with neural networks and other types of machine learning models. It can be used on macOS, iOS, tvOS, and watchOS, and is optimized for using the CPU, GPU, and Apple Neural Engine. Give it a try and leave a ⭐️ if you find it useful 👉: https://github.com/huggingface/exporters I leave you with Stable Diffusion's interpretation of what the end result looks like 😁 https://preview.redd.it/zjwe1e1nw8l91.png?width=1420&format=png&auto=webp&s=bb2c761884633ced550a702fd7e1647aac969e25 submitted by /u/lewtun [link] [comments]  ( 103 min )

Just made a tutorial on how to create a simple JIT compiler for PyTorch graphs using LLVM for those who might be interested in compilers for ML. I did a small detour talking about PyTorch's NNC and how to generate native code for different architectures such as x86, ARM and RISC-V for those who are interested here is the link. submitted by /u/perone [link] [comments]  ( 105 min )

Excellent case study regarding the collection and processing of large amounts of data while complying with GDPR in the autonomous driving industry: https://www.youtube.com/watch?v=DPeqEeSKTYA&t=22s submitted by /u/laramontoyalaske [link] [comments]  ( 103 min )

Denoising Diffusion Probabilistic Models states that if the diffusion step sizes are small enough, the reverse process is also Gaussian. They cite Deep Unsupervised Learning using Nonequilibrium Thermodynamics, and they in turn cite ON THE THEORY OF STOCHASTIC PROCESSES, WITH PARTICULAR REFERENCE TO APPLICATIONS to support this statement. This paper is somewhat physics oriented so I don't quite get why the statement is true. Can someone help me with this? Why is it that for small enough diffusion step sizes, the reverse process is also Gaussian? How could I prove that this is true? submitted by /u/dineNshine [link] [comments]  ( 90 min )

​ https://preview.redd.it/uou5710bi7l91.png?width=1200&format=png&auto=webp&s=5006534121c9b2f25b002c3a500929f616507ee8 More info at https://outsystems-ai-reading-group.github.io/ submitted by /u/JClub [link] [comments]  ( 88 min )

My colleges and I submitted a manuscript to one of the Hindawi journals (Q2). The paper is about applying new machine learning approaches to file carving (a computer forensics field). We submitted the manuscript in January and got rejected recently (after 8 long months) mainly for not citing recent work, which was literally published in the same month we submitted out manuscript (or even after). I’m not writing this to rant about the journal or the unfairness of the long review time. But rather I’m asking for help with the following issue I frequently face: I work hard to write up a manuscript that has competing results, submit it to a decent journal , wait for months or sometimes over a year just to get rejected. After that long wait, obviously the manuscript is no longer showing the latest state of the art and is useless - thus no other journal will publish it since in the mean time new better results surface. If I send the manuscript to multiple journals in the same time and they somehow find out, I get blacklisted and will probably never be able to publish again. When I look at some of the papers in decent journals (Q2 and Q1) I’m often astound that someone actually managed to publish that low quality of work… What am I missing???? submitted by /u/sillyscienceguy [link] [comments]  ( 91 min )

I vaguely remember from the depth of my head once reading about a method roughly named cultural evolution. The method is a low-communication distributed training strategy, where you do distributed data parallel without gradient all-reduce. Instead, a small proportion of data in the batch is fed to every worker, and the outputs for these shared examples are synchronized across workers. (Not all-reduced, so each worker gets a copy of the outputs for every other worker.) Then, each worker is supervised to predict similar outputs on those shared examples to the averaged output of other workers by a consistency loss. Is this a real method ever proposed by someone? Is there a paper about it? Or did I hallucinate it and probably should actually try it myself? submitted by /u/CMS_Flash [link] [comments]  ( 90 min )

What is THUNET? A deep learning net/framework named "TsingHua University NET", short for "THUNET", is for non-commercial, educational, scientific purpose for the deep learning community. How to build a neural network with THUNET? Next, I will explain how to use THUNET to build a model to compute XOR operator. Tutorial-1: XOR operand The XOR operand is that: it tells two operands if they are different or not. Specifically, 1 xor 0 makes 1, and 0 xor 0 makes 0. What You Can Learn? In this tutorial, I am telling how to build a model to act as 'XOR' operator, which is a common problem in Computer Science. After finishing the lesson, readers should be able to create Activation, Loss, Layer, Scheduler and Optimizer objects, which are key components of the deep learning network. Readers wi…  ( 92 min )

Hello! We developed a tool called flockfysh, a command-line tool that utilizes AI + web-scraping to auto-generate or auto-annotate image / object detection datasets. We strived to make it as simple as possible for users to (1) express what kind of data they want, (2) be as seamless as possible, from the people who want to customize lower-level settings to those who prefer a hands off approach, (3) write workflows that are as understandable as possible. You only need three things to run flockfysh - A small sample (~recommended minimum 50 images per label for best results, but definitely can go lower) images annotated in YOLOv5, enough for flockfysh to understand the kinds of images desired, in the train-val-test folder format (place all images in train) - A YAML file specifying the workflow you'd like (see repo for sample, easily adaptable workflows) Here's the link to the tool: https://github.com/teamnebulaco/flockfysh We'd love to hear some feedback on how we can improve the tool! :)) If there's any issues, please, please, pleeease help us out by opening an issue so that we can fix it for everyone. We're also looking for some collaborators to further upgrade the tool - if you're interested, please DM me! Thanks, and have an awesome day! :D submitted by /u/WeAreNebula [link] [comments]  ( 89 min )

A new large-scale image-text pair dataset (747M) just released! Kakaobrain just released COYO-700M at github and huggingfact dataset: Github: https://github.com/kakaobrain/coyo-dataset Huggingface Dataset: https://huggingface.co/datasets/kakaobrain/coyo-700m COYO-700M is a large-scale dataset that contains 747M image-text pairs as well as many other meta-attributes to increase the usability to train various models. To evaluate the quality of the dataset, three popular models (ALIGN, unCLIP, and ViT) were trained on COYO-700M or its subsets from scratch. ​ https://preview.redd.it/m5leeyq2f5l91.png?width=1226&format=png&auto=webp&s=5931b1f68831b21ad7f35006eb91e41c609a9a17 This dataset is freely available for research projects. And, more details on the dataset and models could be found in the up-coming technical report! submitted by /u/Automatic-Car-285 [link] [comments]  ( 88 min )

Current wisdom is that, in practice, deep over-parametrised networks can converge to zero loss on the training data. However, on side projects I often don’t reach zero training loss. My nets often converge at some loss above zero. Given I only have limited compute, I usually only run Adam with a learning rate of 0.001 as I’ve had good experiences with that. Am I just not running enough experiments with sufficiently many different optimisation strategies and hyperparameter settings or has anyone else faced trouble reaching zero training loss reliably, easily and consistently across projects? submitted by /u/lemlo100 [link] [comments]  ( 106 min )

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I have an introductory class on AI starting in a few days. The class is an upper division elective and is very project-heavy. The official prerequisite is just a year of discrete structures (so logic and probability). However, I took their equivalent courses from the math department and so my CS skills are a bit lacking. I’ve only taken intro to CS, which used Java. Most of my seniors recommend taking data structures and, if possible, algorithms before taking the class on AI. The professor said I definitely don’t need to have taken algorithms but I do need to be comfortable at programming and have basic knowledge of data structures. He also said that the class mostly builds off of discrete structures and said that me having taken their equivalents from the math department probably puts me in a good place in preparation for the mathematical/theory side of AI. However, I still wanna take the next few days to bridge the gap and learn a bit about data structures before the class starts. Hence, does anyone have any recommendations for a crash course in data structures or something that doable in a few days? I’m not looking for anything too in-depth, just the basics so that I have a working knowledge. There is no specific language requirement for the course but I hear Python will be the most useful. I have some experience with Python but not a lot. I’d appreciate any input or suggestions though! submitted by /u/mowa0199 [link] [comments]  ( 88 min )

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https://github.com/JoaoLages/diffusers-interpret All images generated during the diffusion process for the phrase \"A cute corgi with the Eiffel Tower in the background\" Generated image for the phrase \"A cute corgi with the Eiffel Tower in the background\" Word importances for the selected region in the image above submitted by /u/JClub [link] [comments]  ( 87 min )

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Greetings on behalf of team Univ.AI!! We are excited to have gotten a huge number of responses for our first public MLOps Fellowship offer. We are happy to announce that we have made our first round of selections. Please note that we have tended to choose those with intermediate ML skills or higher for this round of selections. For those of you whom we have not been able to select this time around, we will have future editions of this program, and we will check with you at the time if you still remain interested. If your name is on the list below, Congratulations! Dr. Pavlos Protopapus and Dr. Rahul Dave are pleased to welcome you to the GHF Fellows cohort of September 2022 for MLOps. The aggregate selection rate of the program is under 5% - among an applicant pool that comprises of extremely talented graduates and professionals from all around the world. This is a proud accomplishment and we hope that you’ll make the best of this opportunity. We have sent an email to all the selected candidates with the formal acceptance letter and further details about the fellowship. We wish you a great learning experience. And Congratulations again. Selected candidates: Brian Goss Johnson Mabgwe Nandakumar Raghu Nick Liu Chris Knorowski Manu Mukerji Joren Gijsbrechts Abhishek Maiti Khor Jia Wei Steven McFarland Barnard Hansel Guzman-Soto Igor Wolford Will Evonosky Colin Wood Gaurav Kumar Jain Alan Oursland submitted by /u/sudhanshu28 [link] [comments]  ( 88 min )

submitted by /u/Tao_Dragon [link] [comments]  ( 90 min )

Only 3 lines of code! That's all it takes to generate imaginative visuals and arts from texts. The newest PaddleHub supports ERNIE_ViLG (a SOTA text-to-image model with Chinese text prompts), Disco Diffusion and Stable Diffusion. GitHub Code: https://github.com/PaddlePaddle/PaddleHub Huggingface Space: https://huggingface.co/spaces/PaddlePaddle/ERNIE-ViLG ​ import paddlehub as hub module = hub.Module(name="ernie_vilg") results = module.generate_image(text_prompts=["巨大的白色城堡"]) # "巨大的白色城堡" means "Huge and white castles". https://preview.redd.it/urolilb9i7l91.png?width=912&format=png&auto=webp&s=edd50948689184779d72a87d29a99d0d0634ed99 import paddlehub as hub module = hub.Module(name=" stable_diffusion ") results = module.generate_image(text_prompts=[" close-up maximalist illustration of panther, by makoto shinkai, akihiko yoshida, yoshitaka amano, super detailed, hd wallpaper, digital art "]) https://preview.redd.it/majxoazai7l91.png?width=1024&format=png&auto=webp&s=54d53288396409ed3416b532206bce6ce207c554 submitted by /u/Aha_IamDaniel [link] [comments]  ( 90 min )

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I've been using AI models to generate images from text prompts for about a year or so now, and while some models like DALL·E 2 are able to make some really amazing images, like the van gogh or henri matisse imitations that look like real paintings. but the older models have an extremely specific look to them that I have no clue how to describe or replicate outside of using AI models. It's a kind of warbly artifact that happens, most often when you try to get them to generate a face or try to morph between two completely different images. Some examples are here, here, and here. I understand that the AI has limitations and isn't perfect, but why do the models generate such a distinctive looking artifact? Is there a way to recreate it without using AI models? submitted by /u/False-Fisherman [link] [comments]  ( 90 min )

I mean the AI can do marvelous job of dreaming things, but the problem is that you can not have consistent characters. Ideally for a movie storyboard you could first develop a character. "Women, brown haired, thirties, caucasian, some freckles, small nose." You know a little bit like character development in a game. But then, that you could have this character stay the same as you put her in new situation with other characters. So you could first fleshen out the characters, then use the AI to dream the storyboard for them. submitted by /u/aluode [link] [comments]  ( 87 min )

Title basically. AI is fascinating to me and Id like to be involved with it in some way submitted by /u/CharmedBySnakes [link] [comments]  ( 88 min )

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I've been trying out DALL-E 2 (i got an invite within a few hours of asking) for character pics. I had an idea for a half orc bard with the trait that give you a bite attack and imagined he'd replaced his fangs for metal teeth. I was trying to get a pic of him singing in a tavern, but the pics all came out with the bard holding paper like he was writing the song. Turns out my dyslexia got the better of me and I typed 'signing', not 'singing'. Example 1 Example 2 Example 3 Example 4 I think I'll call him the Silver-Toothed Brad :) Then I asked GPT3 to give him an backstory: Prompt: Write a backstory for a dyslexic half-orc bard called The Silver-Toothed Brad Result: The Silver-Toothed Brad was born to a poor family of half-orcs in the slums of a large city. He was always different from the other children - he was smaller, weaker, and had trouble reading and writing. When he was old enough, he was sold into slavery and put to work in the city's mines. One day, while he was working, Brad heard a group of miners singing. He was transfixed by their voices and the way they brought the words to life. He begged the miners to teach him how to sing, and they took him under their wing. Brad quickly learned that he had a natural talent for singing. He was soon able to entertain the other miners with his stories and songs. When he was not working in the mines, he was performing in the city's taverns and inns. Despite his love for singing, Brad always felt like an outsider. He was never quite able to fit in with the other half-orcs. They teased him for his dyslexia and for his love of music. But Brad didn't let their teasing get to him. He continued to sing and entertain people with his stories. And he eventually found a group of friends who appreciated him for who he was. It's actually pretty stunning how good that is. submitted by /u/GershBinglander [link] [comments]  ( 89 min )

I want to clarify, main reward function is like R_total=w1r1+w2r2+… So is R_total should be 1 as sum of all rewards, or w1r1, w2r2 … should be =1 ? submitted by /u/IndependenceCivil576 [link] [comments]  ( 87 min )

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A new model that maps developmental pathways to tumor cells may unlock the identity of cancers of unknown primary.  ( 7 min )

This month’s NVIDIA GTC provides the best opportunity yet to learn how leading companies and their designers, planners and operators are using the industrial metaverse to create physically accurate, perfectly synchronized, AI-enabled digital twins. The global conference, which runs online Sept. 19-22, will focus in part on how NVIDIA Omniverse Enterprise enables companies to design Read article > The post NVIDIA GTC Dives Into the Industrial Metaverse, Digital Twins appeared first on NVIDIA Blog.  ( 5 min )

We’d wake you up when September ends, but then you’d miss out on a whole new set of games coming to GeForce NOW. Gear up for 22 games joining the GeForce NOW library, with 19 day-and-date releases including action role-playing game Steelrising. Playing them all will take some serious strategy. And build the perfect Minifigure Read article > The post GFN Thursday Slides Into September With 22 New Games appeared first on NVIDIA Blog.  ( 6 min )

Bias detection in data and model outcomes is a fundamental requirement for building responsible artificial intelligence (AI) and machine learning (ML) models. Unfortunately, detecting bias isn’t an easy task for the vast majority of practitioners due to the large number of ways in which it can be measured and different factors that can contribute to […]  ( 14 min )

submitted by /u/kenickh [link] [comments]  ( 100 min )

Greetings on behalf of team Univ.AI!! We are excited to have gotten a huge number of responses for our first public MLOps Fellowship offer. We are happy to announce that we have made our first round of selections. Please note that we have tended to choose those with intermediate ML skills or higher for this round of selections. For those of you whom we have not been able to select this time around, we will have future editions of this program, and we will check with you at the time if you still remain interested. If your name is on the list below, Congratulations! Dr. Pavlos Protopapus and Dr. Rahul Dave are pleased to welcome you to the GHF Fellows cohort of September 2022 for MLOps. The aggregate selection rate of the program is under 5% - among an applicant pool that comprises of extremely talented graduates and professionals from all around the world. This is a proud accomplishment and we hope that you’ll make the best of this opportunity. We have sent an email to all the selected candidates with the formal acceptance letter and further details about the fellowship. We wish you a great learning experience. And Congratulations again. Selected candidates: Brian Goss Johnson Mabgwe Nandakumar Raghu Nick Liu Chris Knorowski Manu Mukerji Joren Gijsbrechts Abhishek Maiti Khor Jia Wei Steven McFarland Barnard Hansel Guzman-Soto Igor Wolford Will Evonosky Colin Wood Gaurav Kumar Jain Alan Oursland submitted by /u/sudhanshu28 [link] [comments]  ( 88 min )

dataset I have an issue with the number of instances: only one mask https://dip4fish.blogspot.com/2022/09/train-and-prediction-with-lightning.html submitted by /u/jean-pat [link] [comments]  ( 97 min )

Show your visualizations in a web based layout using plotly Dash Continue reading on Becoming Human: Artificial Intelligence Magazine »  ( 12 min )

If a password of length n is made up of lower case letters and digits, with each symbol appearing with equal probability, how many times would you expect to shift between letters and digits when typing the password? If you’re typing the password on a mobile device, how many times would you change between alphabetic […] Runs of letters and digits in passwords first appeared on John D. Cook.  ( 5 min )

Normalizing flows model a complex target distribution in terms of a bijective transform operating on a simple base distribution. As such, they enable tractable computation of a number of important statistical quantities, particularly likelihoods and samples. Despite these appealing properties, the computation of more complex inference tasks, such as the cumulative distribution function (CDF) over a complex region (e.g., a polytope) remains challenging. Traditional CDF approximations using Monte-Carlo techniques are unbiased but have unbounded variance and low sample efficiency. Instead, we build upon the diffeomorphic properties of normalizing flows and leverage the divergence theorem to estimate the CDF over a closed region in target space in terms of the flux across its \emph{boundary}, as induced by the normalizing flow. We describe both deterministic and stochastic instances of this estimator: while the deterministic variant iteratively improves the estimate by strategically subdividing the boundary, the stochastic variant provides unbiased estimates. Our experiments on popular flow architectures and UCI benchmark datasets show a marked improvement in sample efficiency as compared to traditional estimators.  ( 2 min )

A significant body of recent research in the field of Learning Analytics has focused on leveraging machine learning approaches for predicting at-risk students in order to initiate timely interventions and thereby elevate retention and completion rates. The overarching feature of the majority of these research studies has been on the science of prediction only. The component of predictive analytics concerned with interpreting the internals of the models and explaining their predictions for individual cases to stakeholders has largely been neglected. Additionally, works that attempt to employ data-driven prescriptive analytics to automatically generate evidence-based remedial advice for at-risk learners are in their infancy. eXplainable AI is a field that has recently emerged providing cutting-edge tools which support transparent predictive analytics and techniques for generating tailored advice for at-risk students. This study proposes a novel framework that unifies both transparent machine learning as well as techniques for enabling prescriptive analytics. This work practically demonstrates the proposed framework using predictive models for identifying at-risk learners of programme non-completion. The study then further demonstrates how predictive modelling can be augmented with prescriptive analytics on two case studies in order to generate human-readable prescriptive feedback for those who are at risk.

A well-known failure mode of neural networks corresponds to high confidence erroneous predictions, especially for data that somehow differs from the training distribution. Such an unsafe behaviour limits their applicability. To counter that, we show that models offering accurate confidence levels can be defined via adding constraints in their internal representations. That is, we encode class labels as fixed unique binary vectors, or class codes, and use those to enforce class-dependent activation patterns throughout the model. Resulting predictors are dubbed Total Activation Classifiers (TAC), and TAC is used as an additional component to a base classifier to indicate how reliable a prediction is. Given a data instance, TAC slices intermediate representations into disjoint sets and reduces such slices into scalars, yielding activation profiles. During training, activation profiles are pushed towards the code assigned to a given training instance. At testing time, one can predict the class corresponding to the code that best matches the activation profile of an example. Empirically, we observe that the resemblance between activation patterns and their corresponding codes results in an inexpensive unsupervised approach for inducing discriminative confidence scores. Namely, we show that TAC is at least as good as state-of-the-art confidence scores extracted from existing models, while strictly improving the model's value on the rejection setting. TAC was also observed to work well on multiple types of architectures and data modalities.

Improving the user's hearing ability to understand speech in noisy environments is critical to the development of hearing aid (HA) devices. For this, it is important to derive a metric that can fairly predict speech intelligibility for HA users. A straightforward approach is to conduct a subjective listening test and use the test results as an evaluation metric. However, conducting large-scale listening tests is time-consuming and expensive. Therefore, several evaluation metrics were derived as surrogates for subjective listening test results. In this study, we propose a multi-branched speech intelligibility prediction model (MBI-Net), for predicting the subjective intelligibility scores of HA users. MBI-Net consists of two branches of models, with each branch consisting of a hearing loss model, a cross-domain feature extraction module, and a speech intelligibility prediction model, to process speech signals from one channel. The outputs of the two branches are fused through a linear layer to obtain predicted speech intelligibility scores. Experimental results confirm the effectiveness of MBI-Net, which produces higher prediction scores than the baseline system in Track 1 and Track 2 on the Clarity Prediction Challenge 2022 dataset.

Obtaining text datasets with semantic annotations is an effortful process, yet crucial for supervised training in natural language processsing (NLP). In general, developing and applying new NLP pipelines in domain-specific contexts for tasks often requires custom designed datasets to address NLP tasks in supervised machine learning fashion. When operating in non-English languages for medical data processing, this exposes several minor and major, interconnected problems such as lack of task-matching datasets as well as task-specific pre-trained models. In our work we suggest to leverage pretrained language models for training data acquisition in order to retrieve sufficiently large datasets for training smaller and more efficient models for use-case specific tasks. To demonstrate the effectiveness of your approach, we create a custom dataset which we use to train a medical NER model for German texts, GPTNERMED, yet our method remains language-independent in principle. Our obtained dataset as well as our pre-trained models are publicly available at: https://github.com/frankkramer-lab/GPTNERMED

Recovering underlying Directed Acyclic Graph structures (DAG) from observational data is highly challenging due to the combinatorial nature of the DAG-constrained optimization problem. Recently, DAG learning has been cast as a continuous optimization problem by characterizing the DAG constraint as a smooth equality one, generally based on polynomials over adjacency matrices. Existing methods place very small coefficients on high-order polynomial terms for stabilization, since they argue that large coefficients on the higher-order terms are harmful due to numeric exploding. On the contrary, we discover that large coefficients on higher-order terms are beneficial for DAG learning, when the spectral radiuses of the adjacency matrices are small, and that larger coefficients for higher-order terms can approximate the DAG constraints much better than the small counterparts. Based on this, we propose a novel DAG learning method with efficient truncated matrix power iteration to approximate geometric series-based DAG constraints. Empirically, our DAG learning method outperforms the previous state-of-the-arts in various settings, often by a factor of 3 or more in terms of structural Hamming distance.

In this work, the capabilities of an encoder-decoder learning framework are leveraged to predict soft-failure evolution over a long future horizon. This enables the triggering of timely repair actions with low quality-of-transmission (QoT) margins before a costly hard-failure occurs, ultimately reducing the frequency of repair actions and associated operational expenses. Specifically, it is shown that the proposed scheme is capable of triggering a repair action several days prior to the expected day of a hard-failure, contrary to soft-failure detection schemes utilizing rule-based fixed QoT margins, that may lead either to premature repair actions (i.e., several months before the event of a hard-failure) or to repair actions that are taken too late (i.e., after the hard failure has occurred). Both frameworks are evaluated and compared for a lightpath established in an elastic optical network, where soft-failure evolution can be modeled by analyzing bit-error-rate information monitored at the coherent receivers.

Some languages allow arguments to be omitted in certain contexts. Yet human language comprehenders reliably infer the intended referents of these zero pronouns, in part because they construct expectations about which referents are more likely. We ask whether Neural Language Models also extract the same expectations. We test whether 12 contemporary language models display expectations that reflect human behavior when exposed to sentences with zero pronouns from five behavioral experiments conducted in Italian by Carminati (2005). We find that three models - XGLM 2.9B, 4.5B, and 7.5B - capture the human behavior from all the experiments, with others successfully modeling some of the results. This result suggests that human expectations about coreference can be derived from exposure to language, and also indicates features of language models that allow them to better reflect human behavior.

QA models with lifelong learning (LL) abilities are important for practical QA applications, and architecture-based LL methods are reported to be an effective implementation for these models. However, it is non-trivial to extend previous approaches to QA tasks since they either require access to task identities in the testing phase or do not explicitly model samples from unseen tasks. In this paper, we propose Diana: a dynamic architecture-based lifelong QA model that tries to learn a sequence of QA tasks with a prompt enhanced language model. Four types of hierarchically organized prompts are used in Diana to capture QA knowledge from different granularities. Specifically, we dedicate task-level prompts to capture task-specific knowledge to retain high LL performances and maintain instance-level prompts to learn knowledge shared across different input samples to improve the model's generalization performance. Moreover, we dedicate separate prompts to explicitly model unseen tasks and introduce a set of prompt key vectors to facilitate knowledge sharing between tasks. Extensive experiments demonstrate that Diana outperforms state-of-the-art lifelong QA models, especially in handling unseen tasks.

We address the problem of online change detection in multivariate datastreams, and we introduce QuantTree Exponentially Weighted Moving Average (QT-EWMA), a nonparametric change-detection algorithm that can control the expected time before a false alarm, yielding a desired Average Run Length (ARL$_0$). Controlling false alarms is crucial in many applications and is rarely guaranteed by online change-detection algorithms that can monitor multivariate datastreams without knowing the data distribution. Like many change-detection algorithms, QT-EWMA builds a model of the data distribution, in our case a QuantTree histogram, from a stationary training set. To monitor datastreams even when the training set is extremely small, we propose QT-EWMA-update, which incrementally updates the QuantTree histogram during monitoring, always keeping the ARL$_0$ under control. Our experiments, performed on synthetic and real-world datastreams, demonstrate that QT-EWMA and QT-EWMA-update control the ARL$_0$ and the false alarm rate better than state-of-the-art methods operating in similar conditions, achieving lower or comparable detection delays.  ( 2 min )

Multi-view data are commonly encountered in data mining applications. Effective extraction of information from multi-view data requires specific design of clustering methods to cater for data with multiple views, which is non-trivial and challenging. In this paper, we propose a novel one-step multi-view clustering method by exploiting the dual representation of both the common and specific information of different views. The motivation originates from the rationale that multi-view data contain not only the consistent knowledge between views but also the unique knowledge of each view. Meanwhile, to make the representation learning more specific to the clustering task, a one-step learning framework is proposed to integrate representation learning and clustering partition as a whole. With this framework, the representation learning and clustering partition mutually benefit each other, which effectively improve the clustering performance. Results from extensive experiments conducted on benchmark multi-view datasets clearly demonstrate the superiority of the proposed method.

We draw on the latest advancements in the physics community to propose a novel method for discovering the governing non-linear dynamics of physical systems in reinforcement learning (RL). We establish that this method is capable of discovering the underlying dynamics using significantly fewer trajectories (as little as one rollout with $\leq 30$ time steps) than state of the art model learning algorithms. Further, the technique learns a model that is accurate enough to induce near-optimal policies given significantly fewer trajectories than those required by model-free algorithms. It brings the benefits of model-based RL without requiring a model to be developed in advance, for systems that have physics-based dynamics. To establish the validity and applicability of this algorithm, we conduct experiments on four classic control tasks. We found that an optimal policy trained on the discovered dynamics of the underlying system can generalize well. Further, the learned policy performs well when deployed on the actual physical system, thus bridging the model to real system gap. We further compare our method to state-of-the-art model-based and model-free approaches, and show that our method requires fewer trajectories sampled on the true physical system compared other methods. Additionally, we explored approximate dynamics models and found that they also can perform well.

Multi-source data fusion, in which multiple data sources are jointly analyzed to obtain improved information, has considerable research attention. For the datasets of multiple medical institutions, data confidentiality and cross-institutional communication are critical. In such cases, data collaboration (DC) analysis by sharing dimensionality-reduced intermediate representations without iterative cross-institutional communications may be appropriate. Identifiability of the shared data is essential when analyzing data including personal information. In this study, the identifiability of the DC analysis is investigated. The results reveals that the shared intermediate representations are readily identifiable to the original data for supervised learning. This study then proposes a non-readily identifiable DC analysis only sharing non-readily identifiable data for multiple medical datasets including personal information. The proposed method solves identifiability concerns based on a random sample permutation, the concept of interpretable DC analysis, and usage of functions that cannot be reconstructed. In numerical experiments on medical datasets, the proposed method exhibits a non-readily identifiability while maintaining a high recognition performance of the conventional DC analysis. For a hospital dataset, the proposed method exhibits a nine percentage point improvement regarding the recognition performance over the local analysis that uses only local dataset.

Heart murmurs are abnormal sounds present in heartbeats, caused by turbulent blood flow through the heart. The PhysioNet 2022 challenge targets automatic detection of murmur from audio recordings of the heart and automatic detection of normal vs. abnormal clinical outcome. The recordings are captured from multiple locations around the heart. Our participation investigates the effectiveness of self-supervised learning for murmur detection. We evaluate the use of a backbone CNN, whose layers are trained in a self-supervised way with data from both this year's and the 2016 challenge. We use two different augmentations on each training sample, and normalized temperature-scaled cross-entropy loss. We experiment with different augmentations to learn effective phonocardiogram representations. To build the final detectors we train two classification heads, one for each challenge task. We present evaluation results for all combinations of the available augmentations, and for our multiple-augmentation approach.  ( 2 min )

In this paper, we introduce LINKS, a dataset of 100 million one degree of freedom planar linkage mechanisms and 1.1 billion coupler curves, which is more than 1000 times larger than any existing database of planar mechanisms and is not limited to specific kinds of mechanisms such as four-bars, six-bars, \etc which are typically what most databases include. LINKS is made up of various components including 100 million mechanisms, the simulation data for each mechanism, normalized paths generated by each mechanism, a curated set of paths, the code used to generate the data and simulate mechanisms, and a live web demo for interactive design of linkage mechanisms. The curated paths are provided as a measure for removing biases in the paths generated by mechanisms that enable a more even design space representation. In this paper, we discuss the details of how we can generate such a large dataset and how we can overcome major issues with such scales. To be able to generate such a large dataset we introduce a new operator to generate 1-DOF mechanism topologies, furthermore, we take many steps to speed up slow simulations of mechanisms by vectorizing our simulations and parallelizing our simulator on a large number of threads, which leads to a simulation 800 times faster than the simple simulation algorithm. This is necessary given on average, 1 out of 500 candidates that are generated are valid~(and all must be simulated to determine their validity), which means billions of simulations must be performed for the generation of this dataset. Then we demonstrate the depth of our dataset through a bi-directional chamfer distance-based shape retrieval study where we show how our dataset can be used directly to find mechanisms that can trace paths very close to desired target paths.

Federated Learning (FL) has emerged as a prospective solution that facilitates the training of a high-performing centralised model without compromising the privacy of users. While successful, research is currently limited by the possibility of establishing a realistic large-scale FL system at the early stages of experimentation. Simulation can help accelerate this process. To facilitate efficient scalable FL simulation of heterogeneous clients, we design and implement Protea, a flexible and lightweight client profiling component within federated systems using the FL framework Flower. It allows automatically collecting system-level statistics and estimating the resources needed for each client, thus running the simulation in a resource-aware fashion. The results show that our design successfully increases parallelism for 1.66 $\times$ faster wall-clock time and 2.6$\times$ better GPU utilisation, which enables large-scale experiments on heterogeneous clients.

We adapt concepts, methodology, and theory originally developed in the areas of multidimensional scaling and dimensionality reduction for multivariate data to the functional setting. We focus on classical scaling and Isomap -- prototypical methods that have played important roles in these area -- and showcase their use in the context of functional data analysis. In the process, we highlight the crucial role that the ambient metric plays.

Recently, deep learning (DL)-based non-intrusive speech assessment models have attracted great attention. Many studies report that these DL-based models yield satisfactory assessment performance and good flexibility, but their performance in unseen environments remains a challenge. Furthermore, compared to quality scores, fewer studies elaborate deep learning models to estimate intelligibility scores. This study proposes a multi-task speech intelligibility prediction model, called MTI-Net, for simultaneously predicting human and machine intelligibility measures. Specifically, given a speech utterance, MTI-Net is designed to predict human subjective listening test results and word error rate (WER) scores. We also investigate several methods that can improve the prediction performance of MTI-Net. First, we compare different features (including low-level features and embeddings from self-supervised learning (SSL) models) and prediction targets of MTI-Net. Second, we explore the effect of transfer learning and multi-tasking learning on training MTI-Net. Finally, we examine the potential advantages of fine-tuning SSL embeddings. Experimental results demonstrate the effectiveness of using cross-domain features, multi-task learning, and fine-tuning SSL embeddings. Furthermore, it is confirmed that the intelligibility and WER scores predicted by MTI-Net are highly correlated with the ground-truth scores.

We present a non-asymptotic lower bound on the eigenspectrum of the design matrix generated by any linear bandit algorithm with sub-linear regret when the action set has well-behaved curvature. Specifically, we show that the minimum eigenvalue of the expected design matrix grows as $\Omega(\sqrt{n})$ whenever the expected cumulative regret of the algorithm is $O(\sqrt{n})$, where $n$ is the learning horizon, and the action-space has a constant Hessian around the optimal arm. This shows that such action-spaces force a polynomial lower bound rather than a logarithmic lower bound, as shown by \cite{lattimore2017end}, in discrete (i.e., well-separated) action spaces. Furthermore, while the previous result is shown to hold only in the asymptotic regime (as $n \to \infty$), our result for these "locally rich" action spaces is any-time. Additionally, under a mild technical assumption, we obtain a similar lower bound on the minimum eigen value holding with high probability. We apply our result to two practical scenarios -- \emph{model selection} and \emph{clustering} in linear bandits. For model selection, we show that an epoch-based linear bandit algorithm adapts to the true model complexity at a rate exponential in the number of epochs, by virtue of our novel spectral bound. For clustering, we consider a multi agent framework where we show, by leveraging the spectral result, that no forced exploration is necessary -- the agents can run a linear bandit algorithm and estimate their underlying parameters at once, and hence incur a low regret.

Deep learning has been widely employed to solve the Electrical Impedance Tomography (EIT) image reconstruction problem. Most existing physical model-based and learning-based approaches focus on 2D EIT image reconstruction. However, when they are directly extended to the 3D domain, the reconstruction performance in terms of image quality and noise robustness is hardly guaranteed mainly due to the significant increase in dimensionality. This paper presents a learning-based approach for 3D EIT image reconstruction, which is named Transposed convolution with Neurons Network (TN-Net). Simulation and experimental results show the superior performance and generalization ability of TN-Net compared with prevailing 3D EIT image reconstruction algorithms.

Machine learning models are vulnerable to membership inference attacks in which an adversary aims to predict whether or not a particular sample was contained in the target model's training dataset. Existing attack methods have commonly exploited the output information (mostly, losses) solely from the given target model. As a result, in practical scenarios where both the member and non-member samples yield similarly small losses, these methods are naturally unable to differentiate between them. To address this limitation, in this paper, we propose a new attack method, called \system, which can exploit the membership information from the whole training process of the target model for improving the attack performance. To mount the attack in the common black-box setting, we leverage knowledge distillation, and represent the membership information by the losses evaluated on a sequence of intermediate models at different distillation epochs, namely \emph{distilled loss trajectory}, together with the loss from the given target model. Experimental results over different datasets and model architectures demonstrate the great advantage of our attack in terms of different metrics. For example, on CINIC-10, our attack achieves at least 6$\times$ higher true-positive rate at a low false-positive rate of 0.1\% than existing methods. Further analysis demonstrates the general effectiveness of our attack in more strict scenarios.  ( 2 min )

We consider the use of Gaussian process (GP) priors for solving inverse problems in a Bayesian framework. As is well known, the computational complexity of GPs scales cubically in the number of datapoints. We here show that in the context of inverse problems involving integral operators, one faces additional difficulties that hinder inversion on large grids. Furthermore, in that context, covariance matrices can become too large to be stored. By leveraging results about sequential disintegrations of Gaussian measures, we are able to introduce an implicit representation of posterior covariance matrices that reduces the memory footprint by only storing low rank intermediate matrices, while allowing individual elements to be accessed on-the-fly without needing to build full posterior covariance matrices. Moreover, it allows for fast sequential inclusion of new observations. These features are crucial when considering sequential experimental design tasks. We demonstrate our approach by computing sequential data collection plans for excursion set recovery for a gravimetric inverse problem, where the goal is to provide fine resolution estimates of high density regions inside the Stromboli volcano, Italy. Sequential data collection plans are computed by extending the weighted integrated variance reduction (wIVR) criterion to inverse problems. Our results show that this criterion is able to significantly reduce the uncertainty on the excursion volume, reaching close to minimal levels of residual uncertainty. Overall, our techniques allow the advantages of probabilistic models to be brought to bear on large-scale inverse problems arising in the natural sciences.  ( 3 min )

Transformer-based neural networks have achieved state-of-the-art task performance in a number of machine learning domains including natural language processing and computer vision. To further improve their accuracy, recent work has explored the integration of dynamic behavior into these networks in the form of mixture-of-expert (MoE) layers. In this paper, we explore the introduction of MoE layers to optimize a different metric: inference latency. We introduce a novel system named PLANER that takes an existing Transformer-based network and a user-defined latency target and produces an optimized, sparsely-activated version of the original network that tries to meet the latency target while maintaining baseline accuracy. We evaluate PLANER on two real-world language modeling tasks using the Transformer-XL network and achieve inference latency reductions of over 2x at iso-accuracy.

Despite the considerable progress in automatic abdominal multi-organ segmentation from CT/MRI scans in recent years, a comprehensive evaluation of the models' capabilities is hampered by the lack of a large-scale benchmark from diverse clinical scenarios. Constraint by the high cost of collecting and labeling 3D medical data, most of the deep learning models to date are driven by datasets with a limited number of organs of interest or samples, which still limits the power of modern deep models and makes it difficult to provide a fully comprehensive and fair estimate of various methods. To mitigate the limitations, we present AMOS, a large-scale, diverse, clinical dataset for abdominal organ segmentation. AMOS provides 500 CT and 100 MRI scans collected from multi-center, multi-vendor, multi-modality, multi-phase, multi-disease patients, each with voxel-level annotations of 15 abdominal organs, providing challenging examples and test-bed for studying robust segmentation algorithms under diverse targets and scenarios. We further benchmark several state-of-the-art medical segmentation models to evaluate the status of the existing methods on this new challenging dataset. We have made our datasets, benchmark servers, and baselines publicly available, and hope to inspire future research. Information can be found at https://amos22.grand-challenge.org.

We present BioSLAM, a lifelong SLAM framework for learning various new appearances incrementally and maintaining accurate place recognition for previously visited areas. Unlike humans, artificial neural networks suffer from catastrophic forgetting and may forget the previously visited areas when trained with new arrivals. For humans, researchers discover that there exists a memory replay mechanism in the brain to keep the neuron active for previous events. Inspired by this discovery, BioSLAM designs a gated generative replay to control the robot's learning behavior based on the feedback rewards. Specifically, BioSLAM provides a novel dual-memory mechanism for maintenance: 1) a dynamic memory to efficiently learn new observations and 2) a static memory to balance new-old knowledge. When combined with a visual-/LiDAR- based SLAM system, the complete processing pipeline can help the agent incrementally update the place recognition ability, robust to the increasing complexity of long-term place recognition. We demonstrate BioSLAM in two incremental SLAM scenarios. In the first scenario, a LiDAR-based agent continuously travels through a city-scale environment with a 120km trajectory and encounters different types of 3D geometries (open streets, residential areas, commercial buildings). We show that BioSLAM can incrementally update the agent's place recognition ability and outperform the state-of-the-art incremental approach, Generative Replay, by 24%. In the second scenario, a LiDAR-vision-based agent repeatedly travels through a campus-scale area on a 4.5km trajectory. BioSLAM can guarantee the place recognition accuracy to outperform 15\% over the state-of-the-art approaches under different appearances. To our knowledge, BioSLAM is the first memory-enhanced lifelong SLAM system to help incremental place recognition in long-term navigation tasks.

We present a general Fourier analytic technique for constructing orthonormal basis expansions of translation-invariant kernels from orthonormal bases of $\mathscr{L}_2(\mathbb{R})$. This allows us to derive explicit expansions on the real line for (i) Mat\'ern kernels of all half-integer orders in terms of associated Laguerre functions, (ii) the Cauchy kernel in terms of rational functions, and (iii) the Gaussian kernel in terms of Hermite functions.

Probabilistic programs provide an expressive representation language for generative models. Given a probabilistic program, we are interested in the task of posterior inference: estimating a latent variable given a set of observed variables. Existing techniques for inference in probabilistic programs often require choosing many hyper-parameters, are computationally expensive, and/or only work for restricted classes of programs. Here we formulate inference as masked language modeling: given a program, we generate a supervised dataset of variables and assignments, and randomly mask a subset of the assignments. We then train a neural network to unmask the random values, defining an approximate posterior distribution. By optimizing a single neural network across a range of programs we amortize the cost of training, yielding a "foundation" posterior able to do zero-shot inference for new programs. The foundation posterior can also be fine-tuned for a particular program and dataset by optimizing a variational inference objective. We show the efficacy of the approach, zero-shot and fine-tuned, on a benchmark of STAN programs.

Existing singing voice synthesis models (SVS) are usually trained on singing data and depend on either error-prone time-alignment and duration features or explicit music score information. In this paper, we propose Karaoker, a multispeaker Tacotron-based model conditioned on voice characteristic features that is trained exclusively on spoken data without requiring time-alignments. Karaoker synthesizes singing voice and transfers style following a multi-dimensional template extracted from a source waveform of an unseen singer/speaker. The model is jointly conditioned with a single deep convolutional encoder on continuous data including pitch, intensity, harmonicity, formants, cepstral peak prominence and octaves. We extend the text-to-speech training objective with feature reconstruction, classification and speaker identification tasks that guide the model to an accurate result. In addition to multitasking, we also employ a Wasserstein GAN training scheme as well as new losses on the acoustic model's output to further refine the quality of the model.

Machine learning has become omnipresent with applications in various safety-critical domains such as medical, law, and transportation. In these domains, high-stake decisions provided by machine learning necessitate researchers to design interpretable models, where the prediction is understandable to a human. In interpretable machine learning, rule-based classifiers are particularly effective in representing the decision boundary through a set of rules comprising input features. The interpretability of rule-based classifiers is in general related to the size of the rules, where smaller rules are considered more interpretable. To learn such a classifier, the brute-force direct approach is to consider an optimization problem that tries to learn the smallest classification rule that has close to maximum accuracy. This optimization problem is computationally intractable due to its combinatorial nature and thus, the problem is not scalable in large datasets. To this end, in this paper we study the triangular relationship among the accuracy, interpretability, and scalability of learning rule-based classifiers. The contribution of this paper is an interpretable learning framework IMLI, that is based on maximum satisfiability (MaxSAT) for synthesizing classification rules expressible in proposition logic. Despite the progress of MaxSAT solving in the last decade, the straightforward MaxSAT-based solution cannot scale. Therefore, we incorporate an efficient incremental learning technique inside the MaxSAT formulation by integrating mini-batch learning and iterative rule-learning. In our experiments, IMLI achieves the best balance among prediction accuracy, interpretability, and scalability. As an application, we deploy IMLI in learning popular interpretable classifiers such as decision lists and decision sets.

Human ratings are abstract representations of segmentation quality. To approximate human quality ratings on scarce expert data, we train surrogate quality estimation models. We evaluate on a complex multi-class segmentation problem, specifically glioma segmentation, following the BraTS annotation protocol. The training data features quality ratings from 15 expert neuroradiologists on a scale ranging from 1 to 6 stars for various computer-generated and manual 3D annotations. Even though the networks operate on 2D images and with scarce training data, we can approximate segmentation quality within a margin of error comparable to human intra-rater reliability. Segmentation quality prediction has broad applications. While an understanding of segmentation quality is imperative for successful clinical translation of automatic segmentation quality algorithms, it can play an essential role in training new segmentation models. Due to the split-second inference times, it can be directly applied within a loss function or as a fully-automatic dataset curation mechanism in a federated learning setting.

Physiological monitoring in intensive care units (ICU) generates data that can be used in clinical research. However, the recording conditions in clinical settings limit the automated extraction of relevant information from physiological signals due to noise and artifacts. Therefore, removing artifacts before clinical research is essential. Manual annotation by experienced researchers, which is the gold standard for removing artifacts, is time-consuming and costly due to the volume of the data generated in the ICU. In this study, we propose a hybrid artifact detection system that combines a Variational Autoencoder with a statistical detection component for the labeling of artifactual samples to automate the costly process of cleaning physiological recordings. The system is applied to minute-by-minute mean blood pressure signals from an intensive care unit dataset. Its performance is verified by manual annotations made by an expert. We benchmark the performance of our system with two other systems that combine an ARIMA or an autoencoder-based model with our statistical detection component. Our results indicate that the system consistently achieves sensitivity and specificity levels of over 90%. Thus, it provides an initial foundation to automate data cleaning in recordings from ICU.

Accurate traffic forecasting is essential for smart cities to achieve traffic control, route planning, and flow detection. Although many spatial-temporal methods are currently proposed, these methods are deficient in capturing the spatial-temporal dependence of traffic data synchronously. In addition, most of the methods ignore the dynamically changing correlations between road network nodes that arise as traffic data changes. We propose a neural network-based Spatial-Temporal Interactive Dynamic Graph Convolutional Network (STIDGCN) to address the above challenges for traffic forecasting. Specifically, we propose an interactive dynamic graph convolution structure, which divides the sequences at intervals and synchronously captures the traffic data's spatial-temporal dependence through an interactive learning strategy. The interactive learning strategy makes STIDGCN effective for long-term prediction. We also propose a novel dynamic graph convolution module to capture the dynamically changing correlations in the traffic network, consisting of a graph generator and fusion graph convolution. The dynamic graph convolution module can use the input traffic data and pre-defined graph structure to generate a graph structure. It is then fused with the defined adaptive adjacency matrix to generate a dynamic adjacency matrix, which fills the pre-defined graph structure and simulates the generation of dynamic associations between nodes in the road network. Extensive experiments on four real-world traffic flow datasets demonstrate that STIDGCN outperforms the state-of-the-art baseline.

Connected decision boundaries are used in different areas like image segmentation, clustering, alpha-shape or defining a region in nD-space. However, methods for generating such connected decision boundaries using neural networks are lacking in the machine learning literature. While exploring such methods, we found that such decision boundaries can be generated by thresholding a special kind of function called an invex function. We find a connection between invex functions and the connectedness of regions and manifolds, and we apply the connectedness and locality as a foundation for interpreting the nD-data-space. In this paper, we present two methods for constructing invex function using neural networks. The first one is based on intuitions developed visually and constraining the function using our method (Gradient Clipped-Gradient Penalty). The second one is based on later findings on the relationship of invex function to the composition of invertible and convex functions. Using connectedness as a basic interpretation method, we create connected region based classifiers. We show that multiple connected set based classifiers can approximate any classification function. In the experiments section, we first use the invex function for regression and classification tasks to visualize the global optimality and connected set in 2D toy datasets. Furthermore, we use our methods for classification tasks using an ensemble of models as well as using a single model on larger-scale datasets. The experiments show that connected set based classifiers do not have a significant disadvantage over ordinary neural network classifiers. We also evaluate various properties of invex function and connected sets. The overall exploration of this work suggests that invex function is fundamental to understanding and applying locality and connectedness of input space which is useful for multiple tasks.  ( 3 min )

Positive-unlabeled (PU) learning aims at learning a binary classifier from only positive and unlabeled training data. Recent approaches addressed this problem via cost-sensitive learning by developing unbiased loss functions, and their performance was later improved by iterative pseudo-labeling solutions. However, such two-step procedures are vulnerable to incorrectly estimated pseudo-labels, as errors are propagated in later iterations when a new model is trained on erroneous predictions. To prevent such confirmation bias, we propose PUUPL, a novel loss-agnostic training procedure for PU learning that incorporates epistemic uncertainty in pseudo-label selection. By using an ensemble of neural networks and assigning pseudo-labels based on low-uncertainty predictions, we show that PUUPL improves the reliability of pseudo-labels, increasing the predictive performance of our method and leading to new state-of-the-art results in self-training for PU learning. With extensive experiments, we show the effectiveness of our method over different datasets, modalities, and learning tasks, as well as improved calibration, robustness over prior misspecifications, biased positive data, and imbalanced datasets.

We study cooperative online learning in stochastic and adversarial Markov decision process (MDP). That is, in each episode, $m$ agents interact with an MDP simultaneously and share information in order to minimize their individual regret. We consider environments with two types of randomness: \emph{fresh} -- where each agent's trajectory is sampled i.i.d, and \emph{non-fresh} -- where the realization is shared by all agents (but each agent's trajectory is also affected by its own actions). More precisely, with non-fresh randomness the realization of every cost and transition is fixed at the start of each episode, and agents that take the same action in the same state at the same time observe the same cost and next state. We thoroughly analyze all relevant settings, highlight the challenges and differences between the models, and prove nearly-matching regret lower and upper bounds. To our knowledge, we are the first to consider cooperative reinforcement learning (RL) with either non-fresh randomness or in adversarial MDPs.

High-dimensional models often have a large memory footprint and must be quantized after training before being deployed on resource-constrained edge devices for inference tasks. In this work, we develop an information-theoretic framework for the problem of quantizing a linear regressor learned from training data $(\mathbf{X}, \mathbf{y})$, for some underlying statistical relationship $\mathbf{y} = \mathbf{X}\boldsymbol{\theta} + \mathbf{v}$. The learned model, which is an estimate of the latent parameter $\boldsymbol{\theta} \in \mathbb{R}^d$, is constrained to be representable using only $Bd$ bits, where $B \in (0, \infty)$ is a pre-specified budget and $d$ is the dimension. We derive an information-theoretic lower bound for the minimax risk under this setting and propose a matching upper bound using randomized embedding-based algorithms which is tight up to constant factors. The lower and upper bounds together characterize the minimum threshold bit-budget required to achieve a performance risk comparable to the unquantized setting. We also propose randomized Hadamard embeddings that are computationally efficient and are optimal up to a mild logarithmic factor of the lower bound. Our model quantization strategy can be generalized and we show its efficacy by extending the method and upper-bounds to two-layer ReLU neural networks for non-linear regression. Numerical simulations show the improved performance of our proposed scheme as well as its closeness to the lower bound.

Objective: Disease knowledge graphs are a way to connect, organize, and access disparate information about diseases with numerous benefits for artificial intelligence (AI). To create knowledge graphs, it is necessary to extract knowledge from multimodal datasets in the form of relationships between disease concepts and normalize both concepts and relationship types. Methods: We introduce REMAP, a multimodal approach for disease relation extraction and classification. The REMAP machine learning approach jointly embeds a partial, incomplete knowledge graph and a medical language dataset into a compact latent vector space, followed by aligning the multimodal embeddings for optimal disease relation extraction. Results: We apply REMAP approach to a disease knowledge graph with 96,913 relations and a text dataset of 1.24 million sentences. On a dataset annotated by human experts, REMAP improves text-based disease relation extraction by 10.0% (accuracy) and 17.2% (F1-score) by fusing disease knowledge graphs with text information. Further, REMAP leverages text information to recommend new relationships in the knowledge graph, outperforming graph-based methods by 8.4% (accuracy) and 10.4% (F1-score). Conclusion: REMAP is a multimodal approach for extracting and classifying disease relationships by fusing structured knowledge and text information. REMAP provides a flexible neural architecture to easily find, access, and validate AI-driven relationships between disease concepts.

One of the main shortcomings of event data in football, which has been extensively used for analytics in the recent years, is that it still requires manual collection, thus limiting its availability to a reduced number of tournaments. In this work, we propose a deterministic decision tree-based algorithm to automatically extract football events using tracking data, which consists of two steps: (1) a possession step that evaluates which player was in possession of the ball at each frame in the tracking data, as well as the distinct player configurations during the time intervals where the ball is not in play to inform set piece detection; (2) an event detection step that combines the changes in ball possession computed in the first step with the laws of football to determine in-game events and set pieces. The automatically generated events are benchmarked against manually annotated events and we show that in most event categories the proposed methodology achieves $+90\%$ detection rate across different tournaments and tracking data providers. Finally, we demonstrate how the contextual information offered by tracking data can be leveraged to increase the granularity of auto-detected events, and exhibit how the proposed framework may be used to conduct a myriad of data analyses in football.

Cryo-electron microscopy (cryo-EM) has become a tool of fundamental importance in structural biology, helping us understand the basic building blocks of life. The algorithmic challenge of cryo-EM is to jointly estimate the unknown 3D poses and the 3D electron scattering potential of a biomolecule from millions of extremely noisy 2D images. Existing reconstruction algorithms, however, cannot easily keep pace with the rapidly growing size of cryo-EM datasets due to their high computational and memory cost. We introduce cryoAI, an ab initio reconstruction algorithm for homogeneous conformations that uses direct gradient-based optimization of particle poses and the electron scattering potential from single-particle cryo-EM data. CryoAI combines a learned encoder that predicts the poses of each particle image with a physics-based decoder to aggregate each particle image into an implicit representation of the scattering potential volume. This volume is stored in the Fourier domain for computational efficiency and leverages a modern coordinate network architecture for memory efficiency. Combined with a symmetrized loss function, this framework achieves results of a quality on par with state-of-the-art cryo-EM solvers for both simulated and experimental data, one order of magnitude faster for large datasets and with significantly lower memory requirements than existing methods.

The importance of considering related stocks data for the prediction of stock price movement has been shown in many studies, however, advanced graphical techniques for modeling, embedding and analyzing the behavior of interrelated stocks have not been widely exploited for the prediction of stocks price movements yet. The main challenges in this domain are to find a way for modeling the existing relations among an arbitrary set of stocks and to exploit such a model for improving the prediction performance for those stocks. The most of existing methods in this domain rely on basic graph-analysis techniques, with limited prediction power, and suffer from a lack of generality and flexibility. In this paper, we introduce a novel framework, called GCNET that models the relations among an arbitrary set of stocks as a graph structure called influence network and uses a set of history-based prediction models to infer plausible initial labels for a subset of the stock nodes in the graph. Finally, GCNET uses the Graph Convolutional Network algorithm to analyze this partially labeled graph and predicts the next price direction of movement for each stock in the graph. GCNET is a general prediction framework that can be applied for the prediction of the price fluctuations of interacting stocks based on their historical data. Our experiments and evaluations on a set of stocks from the NASDAQ index demonstrate that GCNET significantly improves the performance of SOTA in terms of accuracy and MCC measures.

Randomized smoothing has recently emerged as an effective tool that enables certification of deep neural network classifiers at scale. All prior art on randomized smoothing has focused on isotropic $\ell_p$ certification, which has the advantage of yielding certificates that can be easily compared among isotropic methods via $\ell_p$-norm radius. However, isotropic certification limits the region that can be certified around an input to worst-case adversaries, i.e., it cannot reason about other "close", potentially large, constant prediction safe regions. To alleviate this issue, (i) we theoretically extend the isotropic randomized smoothing $\ell_1$ and $\ell_2$ certificates to their generalized anisotropic counterparts following a simplified analysis. Moreover, (ii) we propose evaluation metrics allowing for the comparison of general certificates - a certificate is superior to another if it certifies a superset region - with the quantification of each certificate through the volume of the certified region. We introduce ANCER, a framework for obtaining anisotropic certificates for a given test set sample via volume maximization. We achieve it by generalizing memory-based certification of data-dependent classifiers. Our empirical results demonstrate that ANCER achieves state-of-the-art $\ell_1$ and $\ell_2$ certified accuracy on CIFAR-10 and ImageNet in the data-dependence setting, while certifying larger regions in terms of volume, highlighting the benefits of moving away from isotropic analysis. Our code is available in https://github.com/MotasemAlfarra/ANCER.

Multiparameter persistent homology has been largely neglected as an input to machine learning algorithms. We consider the use of lattice-based convolutional neural network layers as a tool for the analysis of features arising from multiparameter persistence modules. We find that these show promise as an alternative to convolutions for the classification of multidimensional persistence modules.

Stability certification and identifying a safe and stabilizing initial set are two important concerns in ensuring operational safety, stability, and robustness of dynamical systems. With the advent of machine-learning tools, these issues need to be addressed for the systems with machine-learned components in the feedback loop. To develop a general theory for stability and stabilizability of a neural network (NN)-controlled nonlinear system subject to bounded parametric variation, a Lyapunov-based stability certificate is proposed and is further used to devise a maximal Lipschitz bound for the NN controller, and also a corresponding maximal region-of-attraction (RoA) inside a given safe operating domain. To compute such a robustly stabilizing NN controller that also maximizes the system's long-run utility, a stability-guaranteed training (SGT) algorithm is proposed. The effectiveness of the proposed framework is validated through an illustrative example.

We study the {PAC} learnability of multiwinner voting, focusing on the class of approval-based committee scoring (ABCS) rules. These are voting rules applied on profiles with approval ballots, where each voter approves some of the candidates. According to ABCS rules, each committee of $k$ candidates collects from each voter a score, that depends on the size of the voter's ballot and on the size of its intersection with the committee. Then, committees of maximum score are the winning ones. Our goal is to learn a target rule (i.e., to learn the corresponding scoring function) using information about the winning committees of a small number of sampled profiles. Despite the existence of exponentially many outcomes compared to single-winner elections, we show that the sample complexity is still low: a polynomial number of samples carries enough information for learning the target rule with high confidence and accuracy. Unfortunately, even simple tasks that need to be solved for learning from these samples are intractable. We prove that deciding whether there exists some ABCS rule that makes a given committee winning in a given profile is a computationally hard problem. Our results extend to the class of sequential Thiele rules, which have received attention recently due to their simplicity.

Network data are commonly collected in a variety of applications, representing either directly measured or statistically inferred connections between features of interest. In an increasing number of domains, these networks are collected over time, such as interactions between users of a social media platform on different days, or across multiple subjects, such as in multi-subject studies of brain connectivity. When analyzing multiple large networks, dimensionality reduction techniques are often used to embed networks in a more tractable low-dimensional space. To this end, we develop a framework for principal components analysis (PCA) on collections of networks via a specialized tensor decomposition we term Semi-Symmetric Tensor PCA or SS-TPCA. We derive computationally efficient algorithms for computing our proposed SS-TPCA decomposition and establish statistical efficiency of our approach under a standard low-rank signal plus noise model. Remarkably, we show that SS-TPCA achieves the same estimation accuracy as classical matrix PCA, with error proportional to the square root of the number of vertices in the network and not the number of edges as might be expected. Our framework inherits many of the strengths of classical PCA and is suitable for a wide range of unsupervised learning tasks, including identifying principal networks, isolating meaningful changepoints or outlying observations, and for characterizing the "variability network" of the most varying edges. Finally, we demonstrate the effectiveness of our proposal on simulated data and on an example from empirical legal studies. The techniques used to establish our main consistency results are surprisingly straightforward and may find use in a variety of other network analysis problems.

In this paper, we focus on the problem of modeling dynamic geo-human interactions in streams for online POI recommendations. Specifically, we formulate the in-stream geo-human interaction modeling problem into a novel deep interactive reinforcement learning framework, where an agent is a recommender and an action is a next POI to visit. We uniquely model the reinforcement learning environment as a joint and connected composition of users and geospatial contexts (POIs, POI categories, functional zones). An event that a user visits a POI in stream updates the states of both users and geospatial contexts; the agent perceives the updated environment state to make online recommendations. Specifically, we model a mixed-user event stream by unifying all users, visits, and geospatial contexts as a dynamic knowledge graph stream, in order to model human-human, geo-human, geo-geo interactions. We design an exit mechanism to address the expired information challenge, devise a meta-path method to address the recommendation candidate generation challenge, and develop a new deep policy network structure to address the varying action space challenge, and, finally, propose an effective adversarial training method for optimization. Finally, we present extensive experiments to demonstrate the enhanced performance of our method.

Stochastic graph neural networks (SGNNs) are information processing architectures that learn representations from data over random graphs. SGNNs are trained with respect to the expected performance, which comes with no guarantee about deviations of particular output realizations around the optimal expectation. To overcome this issue, we propose a variance-constrained optimization problem for SGNNs, balancing the expected performance and the stochastic deviation. An alternating primal-dual learning procedure is undertaken that solves the problem by updating the SGNN parameters with gradient descent and the dual variable with gradient ascent. To characterize the explicit effect of the variance-constrained learning, we conduct a theoretical analysis on the variance of the SGNN output and identify a trade-off between the stochastic robustness and the discrimination power. We further analyze the duality gap of the variance-constrained optimization problem and the converging behavior of the primal-dual learning procedure. The former indicates the optimality loss induced by the dual transformation and the latter characterizes the limiting error of the iterative algorithm, both of which guarantee the performance of the variance-constrained learning. Through numerical simulations, we corroborate our theoretical findings and observe a strong expected performance with a controllable standard deviation.

In this work, we present a neural approach to reconstructing rooted tree graphs describing hierarchical interactions, using a novel representation we term the Lowest Common Ancestor Generations (LCAG) matrix. This compact formulation is equivalent to the adjacency matrix, but enables learning a tree's structure from its leaves alone without the prior assumptions required if using the adjacency matrix directly. Employing the LCAG therefore enables the first end-to-end trainable solution which learns the hierarchical structure of varying tree sizes directly, using only the terminal tree leaves to do so. In the case of high-energy particle physics, a particle decay forms a hierarchical tree structure of which only the final products can be observed experimentally, and the large combinatorial space of possible trees makes an analytic solution intractable. We demonstrate the use of the LCAG as a target in the task of predicting simulated particle physics decay structures using both a Transformer encoder and a Neural Relational Inference encoder Graph Neural Network. With this approach, we are able to correctly predict the LCAG purely from leaf features for a maximum tree-depth of $8$ in $92.5\%$ of cases for trees up to $6$ leaves (including) and $59.7\%$ for trees up to $10$ in our simulated dataset.  ( 3 min )

In this paper, we study the combinatorial semi-bandits (CMAB) and focus on reducing the dependency of the batch-size $K$ in the regret bound, where $K$ is the total number of arms that can be pulled or triggered in each round. First, for the setting of CMAB with probabilistically triggered arms (CMAB-T), we discover a novel (directional) triggering probability and variance modulated (TPVM) condition that can replace the previously-used smoothness condition for various applications, such as cascading bandits, online network exploration and online influence maximization. Under this new condition, we propose a BCUCB-T algorithm with variance-aware confidence intervals and conduct regret analysis which reduces the $O(K)$ factor to $O(\log K)$ or $O(\log^2 K)$ in the regret bound, significantly improving the regret bounds for the above applications. Second, for the setting of non-triggering CMAB with independent arms, we propose a SESCB algorithm which leverages on the non-triggering version of the TPVM condition and completely removes the dependency on $K$ in the leading regret. As a valuable by-product, the regret analysis used in this paper can improve several existing results by a factor of $O(\log K)$. Finally, experimental evaluations show our superior performance compared with benchmark algorithms in different applications.  ( 3 min )

In this paper, we introduce Latent Go-Explore (LGE), a simple and general approach based on the Go-Explore paradigm for exploration in reinforcement learning (RL). Go-Explore was initially introduced with a strong domain knowledge constraint for partitioning the state space into cells. However, in most real-world scenarios, drawing domain knowledge from raw observations is complex and tedious. If the cell partitioning is not informative enough, Go-Explore can completely fail to explore the environment. We argue that the Go-Explore approach can be generalized to any environment without domain knowledge and without cells by exploiting a learned latent representation. Thus, we show that LGE can be flexibly combined with any strategy for learning a latent representation. We show that LGE, although simpler than Go-Explore, is more robust and outperforms all state-of-the-art algorithms in terms of pure exploration on multiple hard-exploration environments. The LGE implementation is available as open-source at https://github.com/qgallouedec/lge.  ( 2 min )

We develop fast algorithms and robust software for convex optimization of two-layer neural networks with ReLU activation functions. Our work leverages a convex reformulation of the standard weight-decay penalized training problem as a set of group-$\ell_1$-regularized data-local models, where locality is enforced by polyhedral cone constraints. In the special case of zero-regularization, we show that this problem is exactly equivalent to unconstrained optimization of a convex "gated ReLU" network. For problems with non-zero regularization, we show that convex gated ReLU models obtain data-dependent approximation bounds for the ReLU training problem. To optimize the convex reformulations, we develop an accelerated proximal gradient method and a practical augmented Lagrangian solver. We show that these approaches are faster than standard training heuristics for the non-convex problem, such as SGD, and outperform commercial interior-point solvers. Experimentally, we verify our theoretical results, explore the group-$\ell_1$ regularization path, and scale convex optimization for neural networks to image classification on MNIST and CIFAR-10.

Conservation laws are key theoretical and practical tools for understanding, characterizing, and modeling nonlinear dynamical systems. However, for many complex dynamical systems, the corresponding conserved quantities are difficult to identify, making it hard to analyze their dynamics and build efficient, stable predictive models. Current approaches for discovering conservation laws often depend on detailed dynamical information, such as the equation of motion or fine-grained time measurements, with many recent proposals also relying on black box parametric deep learning methods. We instead reformulate this task as a manifold learning problem and propose a non-parametric approach, combining the Wasserstein metric from optimal transport with diffusion maps, to discover conserved quantities that vary across trajectories sampled from a dynamical system. We test this new approach on a variety of physical systems$\unicode{x2014}$including conservative Hamiltonian systems, dissipative systems, and spatiotemporal systems$\unicode{x2014}$and demonstrate that our manifold learning method is able to both identify the number of conserved quantities and extract their values. Using tools from optimal transport theory and manifold learning, our proposed method provides a direct geometric approach to identifying conservation laws that is both robust and interpretable without requiring an explicit model of the system nor accurate time information.  ( 3 min )

In this paper, we consider a ${\rm U}(1)$-connection graph, that is, a graph where each oriented edge is endowed with a unit modulus complex number which is simply conjugated under orientation flip. A natural replacement for the combinatorial Laplacian is then the so-called magnetic Laplacian, an Hermitian matrix that includes information about the graph's connection. Connection graphs and magnetic Laplacians appear, e.g., in the problem of angular synchronization. In the context of large and dense graphs, we study here sparsifiers of the magnetic Laplacian, i.e., spectral approximations based on subgraphs with few edges. Our approach relies on sampling multi-type spanning forests (MTSFs) using a custom determinantal point process, a distribution over edges that favours diversity. In a word, an MTSF is a spanning subgraph whose connected components are either trees or cycle-rooted trees. The latter partially capture the angular inconsistencies of the connection graph, and thus provide a way to compress information contained in the connection. Interestingly, when this connection graph has weakly inconsistent cycles, samples of this distribution can be obtained by using a random walk with cycle popping. We provide statistical guarantees for a choice of natural estimators of the connection Laplacian, and investigate the practical application of our sparsifiers in two applications.  ( 3 min )

A considerable amount of research is concerned with the generation of realistic sensor data. LiDAR point clouds are generated by complex simulations or learned generative models. The generated data is usually exploited to enable or improve downstream perception algorithms. Two major questions arise from these procedures: First, how to evaluate the realism of the generated data? Second, does more realistic data also lead to better perception performance? This paper addresses both questions and presents a novel metric to quantify the realism of LiDAR point clouds. Relevant features are learned from real-world and synthetic point clouds by training on a proxy classification task. In a series of experiments, we demonstrate the application of our metric to determine the realism of generated LiDAR data and compare the realism estimation of our metric to the performance of a segmentation model. We confirm that our metric provides an indication for the downstream segmentation performance.  ( 2 min )

The use of counterfactual explanations (CFXs) is an increasingly popular explanation strategy for machine learning models. However, recent studies have shown that these explanations may not be robust to changes in the underlying model (e.g., following retraining), which raises questions about their reliability in real-world applications. Existing attempts towards solving this problem are heuristic, and the robustness to model changes of the resulting CFXs is evaluated with only a small number of retrained models, failing to provide exhaustive guarantees. To remedy this, we propose the first notion to formally and deterministically assess the robustness (to model changes) of CFXs for neural networks, that we call {\Delta}-robustness. We introduce an abstraction framework based on interval neural networks to verify the {\Delta}-robustness of CFXs against a possibly infinite set of changes to the model parameters, i.e., weights and biases. We then demonstrate the utility of this approach in two distinct ways. First, we analyse the {\Delta}-robustness of a number of CFX generation methods from the literature and show that they unanimously host significant deficiencies in this regard. Second, we demonstrate how embedding {\Delta}-robustness within existing methods can provide CFXs which are provably robust.  ( 2 min )

The probability of a drought for a particular region is crucial when making decisions related to agriculture. Forecasting this probability is critical for management and challenging at the same time. The prediction model should consider multiple factors with complex relationships across the region of interest and neighbouring regions. We approach this problem by presenting an end-to-end solution based on a spatio-temporal neural network. The model predicts the Palmer Drought Severity Index (PDSI) for subregions of interest. Predictions by climate models provide an additional source of knowledge of the model leading to more accurate drought predictions. Our model has better accuracy than baseline Gradient boosting solutions, as the $R^2$ score for it is $0.90$ compared to $0.85$ for Gradient boosting. Specific attention is on the range of applicability of the model. We examine various regions across the globe to validate them under different conditions. We complement the results with an analysis of how future climate changes for different scenarios affect the PDSI and how our model can help to make better decisions and more sustainable economics.  ( 2 min )

There has been an intense recent activity in embedding of very high dimensional and nonlinear data structures, much of it in the data science and machine learning literature. We survey this activity in four parts. In the first part we cover nonlinear methods such as principal curves, multidimensional scaling, local linear methods, ISOMAP, graph based methods and diffusion mapping, kernel based methods and random projections. The second part is concerned with topological embedding methods, in particular mapping topological properties into persistence diagrams and the Mapper algorithm. Another type of data sets with a tremendous growth is very high-dimensional network data. The task considered in part three is how to embed such data in a vector space of moderate dimension to make the data amenable to traditional techniques such as cluster and classification techniques. Arguably this is the part where the contrast between algorithmic machine learning methods and statistical modeling, the so-called stochastic block modeling, is at its greatest. In the paper, we discuss the pros and cons for the two approaches. The final part of the survey deals with embedding in $\mathbb{R}^ 2$, i.e. visualization. Three methods are presented: $t$-SNE, UMAP and LargeVis based on methods in parts one, two and three, respectively. The methods are illustrated and compared on two simulated data sets; one consisting of a triplet of noisy Ranunculoid curves, and one consisting of networks of increasing complexity generated with stochastic block models and with two types of nodes.

Recent years have seen a surge of novel neural network architectures for the integration of multi-omics data for prediction. Most of the architectures include either encoders alone or encoders and decoders, i.e., autoencoders of various sorts, to transform multi-omics data into latent representations. One important parameter is the depth of integration: the point at which the latent representations are computed or merged, which can be either early, intermediate, or late. The literature on integration methods is growing steadily, however, close to nothing is known about the relative performance of these methods under fair experimental conditions and under consideration of different use cases. We developed a comparison framework that trains and optimizes multi-omics integration methods under equal conditions. We incorporated early integration and four recently published deep learning methods: MOLI, Super.FELT, OmiEmbed, and MOMA. Further, we devised a novel method, Omics Stacking, that combines the advantages of intermediate and late integration. Experiments were conducted on a public drug response data set with multiple omics data (somatic point mutations, somatic copy number profiles and gene expression profiles) that was obtained from cell lines, patient-derived xenografts, and patient samples. Our experiments confirmed that early integration has the lowest predictive performance. Overall, architectures that integrate triplet loss achieved the best results. Statistical differences can, overall, rarely be observed, however, in terms of the average ranks of methods, Super.FELT is consistently performing best in a cross-validation setting and Omics Stacking best in an external test set setting. The source code of all experiments is available under \url{https://github.com/kramerlab/Multi-Omics_analysis}  ( 3 min )

Softwarization, programmable network control and the use of all-encompassing controllers acting at different timescales are heralded as the key drivers for the evolution to next-generation cellular networks. These technologies have fostered newly designed intelligent data-driven solutions for managing large sets of diverse cellular functionalities, basically impossible to implement in traditionally closed cellular architectures. Despite the evident interest of industry on Artificial Intelligence (AI) and Machine Learning (ML) solutions for closed-loop control of the Radio Access Network (RAN), and several research works in the field, their design is far from mainstream, and it is still a sophisticated and often overlooked operation. In this paper, we discuss how to design AI/ML solutions for the intelligent closed-loop control of the Open RAN, providing guidelines and insights based on exemplary solutions with high-performance record. We then show how to embed these solutions into xApps instantiated on the O-RAN near-real-time RAN Intelligent Controller (RIC) through OpenRAN Gym, the first publicly available toolbox for data-driven O-RAN experimentation at scale. We showcase a use case of an xApp developed with OpenRAN Gym and tested on a cellular network with 7 base stations and 42 users deployed on the Colosseum wireless network emulator. Our demonstration shows the high degree of flexibility of the OpenRAN Gym-based xApp development environment, which is independent of deployment scenarios and traffic demand.  ( 3 min )

The alternating current (AC) chance-constrained optimal power flow (CC-OPF) problem addresses the economic efficiency of electricity generation and delivery under generation uncertainty. The latter is intrinsic to modern power grids because of the high amount of renewables. Despite its academic success, the AC CC-OPF problem is highly nonlinear and computationally demanding, which limits its practical impact. For improving the AC-OPF problem complexity/accuracy trade-off, the paper proposes a fast data-driven setup that uses the sparse and hybrid Gaussian processes (GP) framework to model the power flow equations with input uncertainty. We advocate the efficiency of the proposed approach by a numerical study over multiple IEEE test cases showing up to two times faster and more accurate solutions compared to the state-of-the-art methods.  ( 2 min )

In ridepooling systems with electric fleets, charging is a complex decision-making process. Most electric vehicle (EV) taxi services require drivers to make egoistic decisions, leading to decentralized ad-hoc charging strategies. The current state of the mobility system is often lacking or not shared between vehicles, making it impossible to make a system-optimal decision. Most existing approaches do not combine time, location and duration into a comprehensive control algorithm or are unsuitable for real-time operation. We therefore present a real-time predictive charging method for ridepooling services with a single operator, called Idle Time Exploitation (ITX), which predicts the periods where vehicles are idle and exploits these periods to harvest energy. It relies on Graph Convolutional Networks and a linear assignment algorithm to devise an optimal pairing of vehicles and charging stations, in pursuance of maximizing the exploited idle time. We evaluated our approach through extensive simulation studies on real-world datasets from New York City. The results demonstrate that ITX outperforms all baseline methods by at least 5% (equivalent to $70,000 for a 6,000 vehicle operation) per week in terms of a monetary reward function which was modeled to replicate the profitability of a real-world ridepooling system. Moreover, ITX can reduce delays by at least 4.68% in comparison with baseline methods and generally increase passenger comfort by facilitating a better spread of customers across the fleet. Our results also demonstrate that ITX enables vehicles to harvest energy during the day, stabilizing battery levels and increasing resilience to unexpected surges in demand. Lastly, compared to the best-performing baseline strategy, peak loads are reduced by 17.39% which benefits grid operators and paves the way for more sustainable use of the electrical grid.  ( 3 min )

Bandit algorithms have become a reference solution for interactive recommendation. However, as such algorithms directly interact with users for improved recommendations, serious privacy concerns have been raised regarding its practical use. In this work, we propose a differentially private linear contextual bandit algorithm, via a tree-based mechanism to add Laplace or Gaussian noise to model parameters. Our key insight is that as the model converges during online update, the global sensitivity of its parameters shrinks over time (thus named dynamic global sensitivity). Compared with existing solutions, our dynamic global sensitivity analysis allows us to inject less noise to obtain $(\epsilon, \delta)$-differential privacy with added regret caused by noise injection in $\tilde O(\log{T}\sqrt{T}/\epsilon)$. We provide a rigorous theoretical analysis over the amount of noise added via dynamic global sensitivity and the corresponding upper regret bound of our proposed algorithm. Experimental results on both synthetic and real-world datasets confirmed the algorithm's advantage against existing solutions.  ( 2 min )

We present a novel method of learning style-agnostic representation using both style transfer and adversarial learning in the reinforcement learning framework. The style, here, refers to task-irrelevant details such as the color of the background in the images, where generalizing the learned policy across environments with different styles is still a challenge. Focusing on learning style-agnostic representations, our method trains the actor with diverse image styles generated from an inherent adversarial style perturbation generator, which plays a min-max game between the actor and the generator, without demanding expert knowledge for data augmentation or additional class labels for adversarial training. We verify that our method achieves competitive or better performances than the state-of-the-art approaches on Procgen and Distracting Control Suite benchmarks, and further investigate the features extracted from our model, showing that the model better captures the invariants and is less distracted by the shifted style. The code is available at https://github.com/POSTECH-CVLab/style-agnostic-RL.  ( 2 min )

The autoregressive moving average (ARMA) model is a classical, and arguably one of the most studied approaches to model time series data. It has compelling theoretical properties and is widely used among practitioners. More recent deep learning approaches popularize recurrent neural networks (RNNs) and, in particular, long short-term memory (LSTM) cells that have become one of the best performing and most common building blocks in neural time series modeling. While advantageous for time series data or sequences with long-term effects, complex RNN cells are not always a must and can sometimes even be inferior to simpler recurrent approaches. In this work, we introduce the ARMA cell, a simpler, modular, and effective approach for time series modeling in neural networks. This cell can be used in any neural network architecture where recurrent structures are present and naturally handles multivariate time series using vector autoregression. We also introduce the ConvARMA cell as a natural successor for spatially-correlated time series. Our experiments show that the proposed methodology is competitive with popular alternatives in terms of performance while being more robust and compelling due to its simplicity.  ( 2 min )

We prove the familiar Lazy Online Gradient Descent algorithm is universal on polytope domains. That means it gets $O(1)$ pseudo-regret against i.i.d opponents, while simultaneously achieving the well-known $O(\sqrt N)$ worst-case regret bound. For comparison the bulk of the literature focuses on variants of the Hedge (exponential weights) algorithm on the simplex. These can in principle be lifted to general polytopes; however the process is computationally unfeasible for many important classes where the number of vertices grows quickly with the dimension. The lifting procedure also ignores any Euclidean bounds on the cost vectors, and can create extra factors of dimension in the pseudo-regret bound. Gradient Descent is simpler than the handful of purpose-built algorithms for polytopes in the literature, and works in a broader setting. In particular existing algorithms assume the optimiser is unique, while our bound allows for several optimal vertices.

This paper introduces a new type of causal structure, namely multiscale non-stationary directed acyclic graph (MN-DAG), that generalizes DAGs to the time-frequency domain. Our contribution is twofold. First, by leveraging results from spectral and causality theories, we expose a novel probabilistic generative model, which allows to sample an MN-DAG according to user-specified priors concerning the time-dependence and multiscale properties of the causal graph. Second, we devise a Bayesian method for the estimation of MN-DAGs, by means of stochastic variational inference (SVI), called Multiscale Non-Stationary Causal Structure Learner (MN-CASTLE). In addition to direct observations, MN-CASTLE exploits information from the decomposition of the total power spectrum of time series over different time resolutions. In our experiments, we first use the proposed model to generate synthetic data according to a latent MN-DAG, showing that the data generated reproduces well-known features of time series in different domains. Then we compare our learning method MN-CASTLE against baseline models on synthetic data generated with different multiscale and non-stationary settings, confirming the good performance of MN-CASTLE. Finally, we show some insights derived from the application of MN-CASTLE to study the causal structure of 7 global equity markets during the Covid-19 pandemic.

In this work, we present a novel way of computing IPS using a position-bias model for deterministic logging policies. This technique significantly widens the policies on which OPE can be used. We validate this technique using two different experiments on industry-scale data. The OPE results are clearly strongly correlated with the online results, with some constant bias. The estimator requires the examination model to be a reasonably accurate approximation of real user behaviour.

We present the design and baseline results for a new challenge in the ChaLearn meta-learning series, accepted at NeurIPS'22, focusing on "cross-domain" meta-learning. Meta-learning aims to leverage experience gained from previous tasks to solve new tasks efficiently (i.e., with better performance, little training data, and/or modest computational resources). While previous challenges in the series focused on within-domain few-shot learning problems, with the aim of learning efficiently N-way k-shot tasks (i.e., N class classification problems with k training examples), this competition challenges the participants to solve "any-way" and "any-shot" problems drawn from various domains (healthcare, ecology, biology, manufacturing, and others), chosen for their humanitarian and societal impact. To that end, we created Meta-Album, a meta-dataset of 40 image classification datasets from 10 domains, from which we carve out tasks with any number of "ways" (within the range 2-20) and any number of "shots" (within the range 1-20). The competition is with code submission, fully blind-tested on the CodaLab challenge platform. The code of the winners will be open-sourced, enabling the deployment of automated machine learning solutions for few-shot image classification across several domains.

The widespread adoption of handheld devices have fueled rapid growth in new applications. Several of these new applications employ machine learning models to train on user data that is typically private and sensitive. Federated Learning enables machine learning models to train locally on each handheld device while only synchronizing their neuron updates with a server. While this enables user privacy, technology scaling and software advancements have resulted in handheld devices with varying performance capabilities. This results in the training time of federated learning tasks to be dictated by a few low-performance straggler devices, essentially becoming a bottleneck to the entire training process. In this work, we aim to mitigate the performance bottleneck of federated learning by dynamically forming sub-models for stragglers based on their performance and accuracy feedback. To this end, we offer the Invariant Dropout, a dynamic technique that forms a sub-model based on the neuron update threshold. Invariant Dropout uses neuron updates from the non-straggler clients to develop a tailored sub-models for each straggler during each training iteration. All corresponding weights which have a magnitude less than the threshold are dropped for the iteration. We evaluate Invariant Dropout using five real-world mobile clients. Our evaluations show that Invariant Dropout obtains a maximum accuracy gain of 1.4% points over state-of-the-art Ordered Dropout while mitigating performance bottlenecks of stragglers.

We study the combinatorial assignment domain, which includes combinatorial auctions and course allocation. The main challenge in this domain is that the bundle space grows exponentially in the number of items. To address this, several papers have recently proposed machine learning-based preference elicitation algorithms that aim to elicit only the most important information from agents. However, the main shortcoming of this prior work is that it does not model a mechanism's uncertainty over values for not yet elicited bundles. In this paper, we address this shortcoming by presenting a Bayesian Optimization-based Combinatorial Assignment (BOCA) mechanism. Our key technical contribution is to integrate a method for capturing model uncertainty into an iterative combinatorial auction mechanism. Concretely, we design a new method for estimating an upper uncertainty bound that can be used as an acquisition function to determine the next query to the agents. This enables the mechanism to properly explore (and not just exploit) the bundle space during its preference elicitation phase. We run computational experiments in several spectrum auction domains to evaluate BOCA's performance. Our results show that BOCA achieves higher allocative efficiency than state-of-the-art approaches.

Diffusion-based generative models have achieved promising results recently, but raise an array of open questions in terms of conceptual understanding, theoretical analysis, algorithm improvement and extensions to discrete, structured, non-Euclidean domains. This work tries to re-exam the overall framework, in order to gain better theoretical understandings and develop algorithmic extensions for data from arbitrary domains. By viewing diffusion models as latent variable models with unobserved diffusion trajectories and applying maximum likelihood estimation (MLE) with latent trajectories imputed from an auxiliary distribution, we show that both the model construction and the imputation of latent trajectories amount to constructing diffusion bridge processes that achieve deterministic values and constraints at end point, for which we provide a systematic study and a suit of tools. Leveraging our framework, we present 1) a first theoretical error analysis for learning diffusion generation models, and 2) a simple and unified approach to learning on data from different discrete and constrained domains. Experiments show that our methods perform superbly on generating images, semantic segments and 3D point clouds.

Since multidrug combination is widely applied, the accurate prediction of drug-drug interaction (DDI) is becoming more and more critical. In our method, we use graph to represent drug-drug interaction: nodes represent drug; edges represent drug-drug interactions. Based on our assumption, we convert the prediction of DDI to link prediction problem, utilizing known drug node characteristics and DDI types to predict unknown DDI types. This work proposes a Graph Distance Neural Network (GDNN) to predict drug-drug interactions. Firstly, GDNN generates initial features for nodes via target point method, fully including the distance information in the graph. Secondly, GDNN adopts an improved message passing framework to better generate each drug node embedded expression, comprehensively considering the nodes and edges characteristics synchronously. Thirdly, GDNN aggregates the embedded expressions, undergoing MLP processing to generate the final predicted drug interaction type. GDNN achieved Test Hits@20=0.9037 on the ogb-ddi dataset, proving GDNN can predict DDI efficiently.

Contextual multi-armed bandit (MAB) is an important sequential decision-making problem in recommendation systems. A line of works, called the clustering of bandits (CLUB), utilize the collaborative effect over users and dramatically improve the recommendation quality. Owing to the increasing application scale and public concerns about privacy, there is a growing demand to keep user data decentralized and push bandit learning to the local server side. Existing CLUB algorithms, however, are designed under the centralized setting where data are available at a central server. We focus on studying the federated online clustering of bandit (FCLUB) problem, which aims to minimize the total regret while satisfying privacy and communication considerations. We design a new phase-based scheme for cluster detection and a novel asynchronous communication protocol for cooperative bandit learning for this problem. To protect users' privacy, previous differential privacy (DP) definitions are not very suitable, and we propose a new DP notion that acts on the user cluster level. We provide rigorous proofs to show that our algorithm simultaneously achieves (clustered) DP, sublinear communication complexity and sublinear regret. Finally, experimental evaluations show our superior performance compared with benchmark algorithms.

Optical Coherence Tomography(OCT) is a non-invasive technique capturing cross-sectional area of the retina in micro-meter resolutions. It has been widely used as a auxiliary imaging reference to detect eye-related pathology and predict longitudinal progression of the disease characteristics. Retina layer segmentation is one of the crucial feature extraction techniques, where the variations of retinal layer thicknesses and the retinal layer deformation due to the presence of the fluid are highly correlated with multiple epidemic eye diseases like Diabetic Retinopathy(DR) and Age-related Macular Degeneration (AMD). However, these images are acquired from different devices, which have different intensity distribution, or in other words, belong to different imaging domains. This paper proposes a segmentation-guided domain-adaptation method to adapt images from multiple devices into single image domain, where the state-of-art pre-trained segmentation model is available. It avoids the time consumption of manual labelling for the upcoming new dataset and the re-training of the existing network. The semantic consistency and global feature consistency of the network will minimize the hallucination effect that many researchers reported regarding Cycle-Consistent Generative Adversarial Networks(CycleGAN) architecture.

Machine learning using quantum convolutional neural networks (QCNNs) has demonstrated success in both quantum and classical data classification. In previous studies, QCNNs attained a higher classification accuracy than their classical counterparts under the same training conditions in the few-parameter regime. However, the general performance of large-scale quantum models is difficult to examine because of the limited size of quantum circuits, which can be reliably implemented in the near future. We propose transfer learning as an effective strategy for utilizing small QCNNs in the noisy intermediate-scale quantum era to the full extent. In the classical-to-quantum transfer learning framework, a QCNN can solve complex classification problems without requiring a large-scale quantum circuit by utilizing a pre-trained classical convolutional neural network (CNN). We perform numerical simulations of QCNN models with various sets of quantum convolution and pooling operations for MNIST data classification under transfer learning, in which a classical CNN is trained with Fashion-MNIST data. The results show that transfer learning from classical to quantum CNN performs considerably better than purely classical transfer learning models under similar training conditions.

Learning curves plot the expected error of a learning algorithm as a function of the number of labeled input samples. They are widely used by machine learning practitioners as a measure of an algorithm's performance, but classic PAC learning theory cannot explain their behavior. In this paper we introduce a new combinatorial characterization called the VCL dimension that improves and refines the recent results of Bousquet et al. (2021). Our characterization sheds new light on the structure of learning curves by providing fine-grained bounds, and showing that for classes with finite VCL, the rate of decay can be decomposed into a linear component that depends only on the hypothesis class and an exponential component that depends also on the target distribution. In particular, the finer nuance of the VCL dimension implies lower bounds that are quantitatively stronger than the bounds of Bousquet et al. (2021) and qualitatively stronger than classic 'no free lunch' lower bounds. The VCL characterization solves an open problem studied by Antos and Lugosi (1998), who asked in what cases such lower bounds exist. As a corollary, we recover their lower bound for half-spaces in $\mathbb{R}^d$, and we do so in a principled way that should be applicable to other cases as well. Finally, to provide another viewpoint on our work and how it compares to traditional PAC learning bounds, we also present an alternative formulation of our results in a language that is closer to the PAC setting.

Reinforcement learning is commonly associated with training of reward-maximizing (or cost-minimizing) agents, in other words, controllers. It can be applied in model-free or model-based fashion, using a priori or online collected system data to train involved parametric architectures. In general, online reinforcement learning does not guarantee closed loop stability unless special measures are taken, for instance, through learning constraints or tailored training rules. Particularly promising are hybrids of reinforcement learning with "classical" control approaches. In this work, we suggest a method to guarantee practical stability of the system-controller closed loop in a purely online learning setting, i.e., without offline training. Moreover, we assume only partial knowledge of the system model. To achieve the claimed results, we employ techniques of classical adaptive control. The implementation of the overall control scheme is provided explicitly in a digital, sampled setting. That is, the controller receives the state of the system and computes the control action at discrete, specifically, equidistant moments in time. The method is tested in adaptive traction control and cruise control where it proved to significantly reduce the cost.

Approaches based on generative adversarial networks for imitation learning are promising because they are sample efficient in terms of expert demonstrations. However, training a generator requires many interactions with the actual environment because model-free reinforcement learning is adopted to update a policy. To improve the sample efficiency using model-based reinforcement learning, we propose model-based Entropy-Regularized Imitation Learning (MB-ERIL) under the entropy-regularized Markov decision process to reduce the number of interactions with the actual environment. MB-ERIL uses two discriminators. A policy discriminator distinguishes the actions generated by a robot from expert ones, and a model discriminator distinguishes the counterfactual state transitions generated by the model from the actual ones. We derive structured discriminators so that the learning of the policy and the model is efficient. Computer simulations and real robot experiments show that MB-ERIL achieves a competitive performance and significantly improves the sample efficiency compared to baseline methods.

With the increasing use of Machine Learning (ML) in critical autonomous systems, runtime monitors have been developed to detect prediction errors and keep the system in a safe state during operations. Monitors have been proposed for different applications involving diverse perception tasks and ML models, and specific evaluation procedures and metrics are used for different contexts. This paper introduces three unified safety-oriented metrics, representing the safety benefits of the monitor (Safety Gain), the remaining safety gaps after using it (Residual Hazard), and its negative impact on the system's performance (Availability Cost). To compute these metrics, one requires to define two return functions, representing how a given ML prediction will impact expected future rewards and hazards. Three use-cases (classification, drone landing, and autonomous driving) are used to demonstrate how metrics from the literature can be expressed in terms of the proposed metrics. Experimental results on these examples show how different evaluation choices impact the perceived performance of a monitor. As our formalism requires us to formulate explicit safety assumptions, it allows us to ensure that the evaluation conducted matches the high-level system requirements.

In this work we propose a new paradigm for designing efficient deep unrolling networks using dimensionality reduction schemes, including minibatch gradient approximation and operator sketching. The deep unrolling networks are currently the state-of-the-art solutions for imaging inverse problems. However, for high-dimensional imaging tasks, especially X-ray CT and MRI imaging, the deep unrolling schemes typically become inefficient both in terms of memory and computation, due to the need of computing multiple times the high-dimensional forward and adjoint operators. Recently researchers have found that such limitations can be partially addressed by unrolling the stochastic gradient descent (SGD), inspired by the success of stochastic first-order optimization. In this work, we explore further this direction and propose first a more expressive and practical stochastic primal-dual unrolling, based on the state-of-the-art Learned Primal-Dual (LPD) network, and also a further acceleration upon stochastic primal-dual unrolling, using sketching techniques to approximate products in the high-dimensional image space. The operator sketching can be jointly applied with stochastic unrolling for the best acceleration and compression performance. Our numerical experiments on X-ray CT image reconstruction demonstrate the remarkable effectiveness of our accelerated unrolling schemes.

Cadences are complex structures that have been driving music from the beginning of contrapuntal polyphony until today. Detecting such structures is vital for numerous MIR tasks such as musicological analysis, key detection, or music segmentation. However, automatic cadence detection remains challenging mainly because it involves a combination of high-level musical elements like harmony, voice leading, and rhythm. In this work, we present a graph representation of symbolic scores as an intermediate means to solve the cadence detection task. We approach cadence detection as an imbalanced node classification problem using a Graph Convolutional Network. We obtain results that are roughly on par with the state of the art, and we present a model capable of making predictions at multiple levels of granularity, from individual notes to beats, thanks to the fine-grained, note-by-note representation. Moreover, our experiments suggest that graph convolution can learn non-local features that assist in cadence detection, freeing us from the need of having to devise specialized features that encode non-local context. We argue that this general approach to modeling musical scores and classification tasks has a number of potential advantages, beyond the specific recognition task presented here.

Semi-supervised Anomaly Detection (AD) is a kind of data mining task which aims at learning features from partially-labeled datasets to help detect outliers. In this paper, we classify existing semi-supervised AD methods into two categories: unsupervised-based and supervised-based, and point out that most of them suffer from insufficient exploitation of labeled data and under-exploration of unlabeled data. To tackle these problems, we propose Deep Anomaly Detection and Search (DADS), which applies Reinforcement Learning (RL) to balance exploitation and exploration. During the training process, the agent searches for possible anomalies with hierarchically-structured datasets and uses the searched anomalies to enhance performance, which in essence draws lessons from the idea of ensemble learning. Experimentally, we compare DADS with several state-of-the-art methods in the settings of leveraging labeled known anomalies to detect both other known anomalies and unknown anomalies. Results show that DADS can efficiently and precisely search anomalies from unlabeled data and learn from them, thus achieving good performance.

In this paper, we use the concept of artificial risk fields to predict how human operators control a vehicle in response to upcoming road situations. A risk field assigns a non-negative risk measure to the state of the system in order to model how close that state is to violating a safety property, such as hitting an obstacle or exiting the road. Using risk fields, we construct a stochastic model of the operator that maps from states to likely actions. We demonstrate our approach on a driving task wherein human subjects are asked to drive a car inside a realistic driving simulator while avoiding obstacles placed on the road. We show that the most likely risk field given the driving data is obtained by solving a convex optimization problem. Next, we apply the inferred risk fields to generate distinct driving behaviors while comparing predicted trajectories against ground truth measurements. We observe that the risk fields are excellent at predicting future trajectory distributions with high prediction accuracy for up to twenty seconds prediction horizons. At the same time, we observe some challenges such as the inability to account for how drivers choose to accelerate/decelerate based on the road conditions.

Deployment efficiency is an important criterion for many real-world applications of reinforcement learning (RL). Despite the community's increasing interest, there lacks a formal theoretical formulation for the problem. In this paper, we propose such a formulation for deployment-efficient RL (DE-RL) from an "optimization with constraints" perspective: we are interested in exploring an MDP and obtaining a near-optimal policy within minimal \emph{deployment complexity}, whereas in each deployment the policy can sample a large batch of data. Using finite-horizon linear MDPs as a concrete structural model, we reveal the fundamental limit in achieving deployment efficiency by establishing information-theoretic lower bounds, and provide algorithms that achieve the optimal deployment efficiency. Moreover, our formulation for DE-RL is flexible and can serve as a building block for other practically relevant settings; we give "Safe DE-RL" and "Sample-Efficient DE-RL" as two examples, which may be worth future investigation.

Contrastive learning has proven effective for pre-training image models on unlabeled data with promising results for tasks such as medical image classification. Using paired text (like radiological reports) during pre-training improves the results even further. Still, most existing methods target image classification downstream tasks and may not be optimal for localized tasks like semantic segmentation or object detection. We therefore propose Localized representation learning from Vision and Text (LoVT), to our best knowledge, the first text-supervised pre-training method that targets localized medical imaging tasks. Our method combines instance-level image-report contrastive learning with local contrastive learning on image region and report sentence representations. We evaluate LoVT and commonly used pre-training methods on an evaluation framework of 18 localized tasks on chest X-rays from five public datasets. LoVT performs best on 10 of the 18 studied tasks making it the preferred method of choice for localized tasks.

Gaussian processes are arguably the most important model class in spatial statistics. They encode prior information about the modeled function and can be used for exact or approximate Bayesian inference. In many applications, particularly in physical sciences and engineering, but also in areas such as geostatistics and neuroscience, invariance to symmetries is one of the most fundamental forms of prior information one can consider. The invariance of a Gaussian process' covariance to such symmetries gives rise to the most natural generalization of the concept of stationarity to such spaces. In this work, we develop constructive and practical techniques for building stationary Gaussian processes on a very large class of non-Euclidean spaces arising in the context of symmetries. Our techniques make it possible to (i) calculate covariance kernels and (ii) sample from prior and posterior Gaussian processes defined on such spaces, both in a practical manner. This work is split into two parts, each involving different technical considerations: part I studies compact spaces, while part II studies non-compact spaces possessing certain structure. Our contributions make the non-Euclidean Gaussian process models we study compatible with well-understood computational techniques available in standard Gaussian process software packages, thereby making them accessible to practitioners.

A primary goal of computer experiments is to reconstruct the function given by the computer code via scattered evaluations. Traditional isotropic Gaussian process models suffer from the curse of dimensionality, when the input dimension is relatively high given limited data points. Gaussian process models with additive correlation functions are scalable to dimensionality, but they are more restrictive as they only work for additive functions. In this work, we consider a projection pursuit model, in which the nonparametric part is driven by an additive Gaussian process regression. We choose the dimension of the additive function higher than the original input dimension, and call this strategy "dimension expansion". We show that dimension expansion can help approximate more complex functions. A gradient descent algorithm is proposed for model training based on the maximum likelihood estimation. Simulation studies show that the proposed method outperforms the traditional Gaussian process models. The Supplementary Materials are available online.

Deep-learning-based device fingerprinting has recently been recognized as a key enabler for automated network access authentication. Its robustness to impersonation attacks due to the inherent difficulty of replicating physical features is what distinguishes it from conventional cryptographic solutions. Although device fingerprinting has shown promising performances, its sensitivity to changes in the network operating environment still poses a major limitation. This paper presents an experimental framework that aims to study and overcome the sensitivity of LoRa-enabled device fingerprinting to such changes. We first begin by describing RF datasets we collected using our LoRa-enabled wireless device testbed. We then propose a new fingerprinting technique that exploits out-of-band distortion information caused by hardware impairments to increase the fingerprinting accuracy. Finally, we experimentally study and analyze the sensitivity of LoRa RF fingerprinting to various network setting changes. Our results show that fingerprinting does relatively well when the learning models are trained and tested under the same settings. However, when trained and tested under different settings, these models exhibit moderate sensitivity to channel condition changes and severe sensitivity to protocol configuration and receiver hardware changes when IQ data is used as input. However, with FFT data is used as input, they perform poorly under any change.

Concept-based interpretations of black-box models are often more intuitive for humans to understand. The most widely adopted approach for concept-based interpretation is Concept Activation Vector (CAV). CAV relies on learning a linear relation between some latent representation of a given model and concepts. The linear separability is usually implicitly assumed but does not hold true in general. In this work, we started from the original intent of concept-based interpretation and proposed Concept Gradient (CG), extending concept-based interpretation beyond linear concept functions. We showed that for a general (potentially non-linear) concept, we can mathematically evaluate how a small change of concept affecting the model's prediction, which leads to an extension of gradient-based interpretation to the concept space. We demonstrated empirically that CG outperforms CAV in both toy examples and real world datasets.

The ability to detect zero-day (novel) attacks has become essential in the network security industry. Due to ever evolving attack signatures, existing network intrusion detection systems often fail to detect these threats. This project aims to solve the task of detecting zero-day DDoS (distributed denial-of-service) attacks by utilizing network traffic that is captured before entering a private network. Modern feature extraction techniques are used in conjunction with neural networks to determine if a network packet is either benign or malicious.

Most unsupervised domain adaptation (UDA) methods assume that labeled source images are available during model adaptation. However, this assumption is often infeasible owing to confidentiality issues or memory constraints on mobile devices. To address these problems, we propose a simple yet effective source-free UDA method that uses only a pre-trained source model and unlabeled target images. Our method captures the aleatoric uncertainty by incorporating data augmentation and trains the feature generator with two consistency objectives. The feature generator is encouraged to learn consistent visual features away from the decision boundaries of the head classifier. Inspired by self-supervised learning, our method promotes inter-space alignment between the prediction space and the feature space while incorporating intra-space consistency within the feature space to reduce the domain gap between the source and target domains. We also consider epistemic uncertainty to boost the model adaptation performance. Extensive experiments on popular UDA benchmarks demonstrate that the performance of our approach is comparable or even superior to vanilla UDA methods without using source images or network modifications.

We report on a novel model linking deep convolutional neural networks (CNN) to biological vision and fundamental particle physics. Information propagation in a CNN is modeled via an analogy to an optical system, where information is concentrated near a bottleneck where the 2D spatial resolution collapses about a focal point $1\times 1=1$. A 3D space $(x,y,t)$ is defined by $(x,y)$ coordinates in the image plane and CNN layer $t$, where a principal ray $(0,0,t)$ runs in the direction of information propagation through both the optical axis and the image center pixel located at $(x,y)=(0,0)$, about which the sharpest possible spatial focus is limited to a circle of confusion in the image plane. Our novel insight is to model the principal optical ray $(0,0,t)$ as geometrically equivalent to the medial vector in the positive orthant $I(x,y) \in R^{N+}$ of a $N$-channel activation space, e.g. along the greyscale (or luminance) vector $(t,t,t)$ in $RGB$ colour space. Information is thus concentrated into an energy potential $E(x,y,t)=\|I(x,y,t)\|^2$, which, particularly for bottleneck layers $t$ of generic CNNs, is highly concentrated and symmetric about the spatial origin $(0,0,t)$ and exhibits the well-known "Sombrero" potential of the boson particle. This symmetry is broken in classification, where bottleneck layers of generic pre-trained CNN models exhibit a consistent class-specific bias towards an angle $\theta \in U(1)$ defined simultaneously in the image plane and in activation feature space. Initial observations validate our hypothesis from generic pre-trained CNN activation maps and a bare-bones memory-based classification scheme, with no training or tuning. Training from scratch using combined one-hot $+ U(1)$ loss improves classification for all tasks tested including ImageNet.

Diagonal linear networks (DLNs) are a toy simplification of artificial neural networks; they consist in a quadratic reparametrization of linear regression inducing a sparse implicit regularization. In this paper, we describe the trajectory of the gradient flow of DLNs in the limit of small initialization. We show that incremental learning is effectively performed in the limit: coordinates are successively activated, while the iterate is the minimizer of the loss constrained to have support on the active coordinates only. This shows that the sparse implicit regularization of DLNs decreases with time. This work is restricted to the underparametrized regime with anti-correlated features for technical reasons.

For orthogonal multiple access (OMA) systems, the number of served user equipments (UEs) is limited to the number of available orthogonal resources. On the other hand, non-orthogonal multiple access (NOMA) schemes allow multiple UEs to use the same orthogonal resource. This extra degree of freedom introduces new challenges for resource allocation. Buffer state information (BSI), like the size and age of packets waiting for transmission, can be used to improve scheduling in OMA systems. In this paper, we investigate the impact of BSI on the performance of a centralized scheduler in an uplink multi-carrier NOMA scenario with UEs having various data rate and latency requirements. To handle the large combinatorial space of allocating UEs to the resources, we propose a novel scheduler based on actor-critic reinforcement learning incorporating BSI. Training and evaluation are carried out using Nokia's "wireless suite". We propose various novel techniques to both stabilize and speed up training. The proposed scheduler outperforms benchmark schedulers.

The research of extending deep reinforcement learning (drl) to multi-agent field has solved many complicated problems and made great achievements. However, almost all these studies only focus on discrete or continuous action space and there are few works having ever used multi-agent deep reinforcement learning to real-world environment problems which mostly have a hybrid action space. Therefore, in this paper, we propose two algorithms: deep multi-agent hybrid soft actor-critic (MAHSAC) and multi-agent hybrid deep deterministic policy gradients (MAHDDPG) to fill this gap. This two algorithms follow the centralized training and decentralized execution (CTDE) paradigm and could handle hybrid action space problems. Our experiences are running on multi-agent particle environment which is an easy multi-agent particle world, along with some basic simulated physics. The experimental results show that these algorithms have good performances.  ( 2 min )

Benefiting from the search efficiency, differentiable neural architecture search (NAS) has evolved as the most dominant alternative to automatically design competitive deep neural networks (DNNs). We note that DNNs must be executed under strictly hard performance constraints in real-world scenarios, for example, the runtime latency on autonomous vehicles. However, to obtain the architecture that meets the given performance constraint, previous hardware-aware differentiable NAS methods have to repeat a plethora of search runs to manually tune the hyper-parameters by trial and error, and thus the total design cost increases proportionally. To resolve this, we introduce a lightweight hardware-aware differentiable NAS framework dubbed LightNAS, striving to find the required architecture that satisfies various performance constraints through a one-time search (i.e., \underline{\textit{you only search once}}). Extensive experiments are conducted to show the superiority of LightNAS over previous state-of-the-art methods.  ( 2 min )

Temporal variations of apparent magnitude, called light curves, are observational statistics of interest captured by telescopes over long periods of time. Light curves afford the exploration of Space Domain Awareness (SDA) objectives such as object identification or pose estimation as latent variable inference problems. Ground-based observations from commercial off the shelf (COTS) cameras remain inexpensive compared to higher precision instruments, however, limited sensor availability combined with noisier observations can produce gappy time-series data that can be difficult to model. These external factors confound the automated exploitation of light curves, which makes light curve prediction and extrapolation a crucial problem for applications. Traditionally, image or time-series completion problems have been approached with diffusion-based or exemplar-based methods. More recently, Deep Neural Networks (DNNs) have become the tool of choice due to their empirical success at learning complex nonlinear embeddings. However, DNNs often require large training data that are not necessarily available when looking at unique features of a light curve of a single satellite. In this paper, we present a novel approach to predicting missing and future data points of light curves using Gaussian Processes (GPs). GPs are non-linear probabilistic models that infer posterior distributions over functions and naturally quantify uncertainty. However, the cubic scaling of GP inference and training is a major barrier to their adoption in applications. In particular, a single light curve can feature hundreds of thousands of observations, which is well beyond the practical realization limits of a conventional GP on a single machine. Consequently, we employ MuyGPs, a scalable framework for hyperparameter estimation of GP models that uses nearest neighbors sparsification and local cross-validation. MuyGPs...

Gaussian processes are arguably the most important model class in spatial statistics. They encode prior information about the modeled function and can be used for exact or approximate Bayesian inference. In many applications, particularly in physical sciences and engineering, but also in areas such as geostatistics and neuroscience, invariance to symmetries is one of the most fundamental forms of prior information one can consider. The invariance of a Gaussian process' covariance to such symmetries gives rise to the most natural generalization of the concept of stationarity to such spaces. In this work, we develop constructive and practical techniques for building stationary Gaussian processes on a very large class of non-Euclidean spaces arising in the context of symmetries. Our techniques make it possible to (i) calculate covariance kernels and (ii) sample from prior and posterior Gaussian processes defined on such spaces, both in a practical manner. This work is split into two parts, each involving different technical considerations: part I studies compact spaces, while part II studies non-compact spaces possessing certain structure. Our contributions make the non-Euclidean Gaussian process models we study compatible with well-understood computational techniques available in standard Gaussian process software packages, thereby making them accessible to practitioners.

Probabilistic programs provide an expressive representation language for generative models. Given a probabilistic program, we are interested in the task of posterior inference: estimating a latent variable given a set of observed variables. Existing techniques for inference in probabilistic programs often require choosing many hyper-parameters, are computationally expensive, and/or only work for restricted classes of programs. Here we formulate inference as masked language modeling: given a program, we generate a supervised dataset of variables and assignments, and randomly mask a subset of the assignments. We then train a neural network to unmask the random values, defining an approximate posterior distribution. By optimizing a single neural network across a range of programs we amortize the cost of training, yielding a "foundation" posterior able to do zero-shot inference for new programs. The foundation posterior can also be fine-tuned for a particular program and dataset by optimizing a variational inference objective. We show the efficacy of the approach, zero-shot and fine-tuned, on a benchmark of STAN programs.

We present a general Fourier analytic technique for constructing orthonormal basis expansions of translation-invariant kernels from orthonormal bases of $\mathscr{L}_2(\mathbb{R})$. This allows us to derive explicit expansions on the real line for (i) Mat\'ern kernels of all half-integer orders in terms of associated Laguerre functions, (ii) the Cauchy kernel in terms of rational functions, and (iii) the Gaussian kernel in terms of Hermite functions.

Bandit algorithms have become a reference solution for interactive recommendation. However, as such algorithms directly interact with users for improved recommendations, serious privacy concerns have been raised regarding its practical use. In this work, we propose a differentially private linear contextual bandit algorithm, via a tree-based mechanism to add Laplace or Gaussian noise to model parameters. Our key insight is that as the model converges during online update, the global sensitivity of its parameters shrinks over time (thus named dynamic global sensitivity). Compared with existing solutions, our dynamic global sensitivity analysis allows us to inject less noise to obtain $(\epsilon, \delta)$-differential privacy with added regret caused by noise injection in $\tilde O(\log{T}\sqrt{T}/\epsilon)$. We provide a rigorous theoretical analysis over the amount of noise added via dynamic global sensitivity and the corresponding upper regret bound of our proposed algorithm. Experimental results on both synthetic and real-world datasets confirmed the algorithm's advantage against existing solutions.

The network embedding task is to represent the node in the network as a low-dimensional vector while incorporating the topological and structural information. Most existing approaches solve this problem by factorizing a proximity matrix, either directly or implicitly. In this work, we introduce a network embedding method from a new perspective, which leverages Modern Hopfield Networks (MHN) for associative learning. Our network learns associations between the content of each node and that node's neighbors. These associations serve as memories in the MHN. The recurrent dynamics of the network make it possible to recover the masked node, given that node's neighbors. Our proposed method is evaluated on different downstream tasks such as node classification and linkage prediction. The results show competitive performance compared to the common matrix factorization techniques and deep learning based methods.

In this paper, we study the combinatorial semi-bandits (CMAB) and focus on reducing the dependency of the batch-size $K$ in the regret bound, where $K$ is the total number of arms that can be pulled or triggered in each round. First, for the setting of CMAB with probabilistically triggered arms (CMAB-T), we discover a novel (directional) triggering probability and variance modulated (TPVM) condition that can replace the previously-used smoothness condition for various applications, such as cascading bandits, online network exploration and online influence maximization. Under this new condition, we propose a BCUCB-T algorithm with variance-aware confidence intervals and conduct regret analysis which reduces the $O(K)$ factor to $O(\log K)$ or $O(\log^2 K)$ in the regret bound, significantly improving the regret bounds for the above applications. Second, for the setting of non-triggering CMAB with independent arms, we propose a SESCB algorithm which leverages on the non-triggering version of the TPVM condition and completely removes the dependency on $K$ in the leading regret. As a valuable by-product, the regret analysis used in this paper can improve several existing results by a factor of $O(\log K)$. Finally, experimental evaluations show our superior performance compared with benchmark algorithms in different applications.

We present a non-asymptotic lower bound on the eigenspectrum of the design matrix generated by any linear bandit algorithm with sub-linear regret when the action set has well-behaved curvature. Specifically, we show that the minimum eigenvalue of the expected design matrix grows as $\Omega(\sqrt{n})$ whenever the expected cumulative regret of the algorithm is $O(\sqrt{n})$, where $n$ is the learning horizon, and the action-space has a constant Hessian around the optimal arm. This shows that such action-spaces force a polynomial lower bound rather than a logarithmic lower bound, as shown by \cite{lattimore2017end}, in discrete (i.e., well-separated) action spaces. Furthermore, while the previous result is shown to hold only in the asymptotic regime (as $n \to \infty$), our result for these "locally rich" action spaces is any-time. Additionally, under a mild technical assumption, we obtain a similar lower bound on the minimum eigen value holding with high probability. We apply our result to two practical scenarios -- \emph{model selection} and \emph{clustering} in linear bandits. For model selection, we show that an epoch-based linear bandit algorithm adapts to the true model complexity at a rate exponential in the number of epochs, by virtue of our novel spectral bound. For clustering, we consider a multi agent framework where we show, by leveraging the spectral result, that no forced exploration is necessary -- the agents can run a linear bandit algorithm and estimate their underlying parameters at once, and hence incur a low regret.

In this paper, we consider a ${\rm U}(1)$-connection graph, that is, a graph where each oriented edge is endowed with a unit modulus complex number which is simply conjugated under orientation flip. A natural replacement for the combinatorial Laplacian is then the so-called magnetic Laplacian, an Hermitian matrix that includes information about the graph's connection. Connection graphs and magnetic Laplacians appear, e.g., in the problem of angular synchronization. In the context of large and dense graphs, we study here sparsifiers of the magnetic Laplacian, i.e., spectral approximations based on subgraphs with few edges. Our approach relies on sampling multi-type spanning forests (MTSFs) using a custom determinantal point process, a distribution over edges that favours diversity. In a word, an MTSF is a spanning subgraph whose connected components are either trees or cycle-rooted trees. The latter partially capture the angular inconsistencies of the connection graph, and thus provide a way to compress information contained in the connection. Interestingly, when this connection graph has weakly inconsistent cycles, samples of this distribution can be obtained by using a random walk with cycle popping. We provide statistical guarantees for a choice of natural estimators of the connection Laplacian, and investigate the practical application of our sparsifiers in two applications.

Suppose we observe a random vector $X$ from some distribution $P$ in a known family with unknown parameters. We ask the following question: when is it possible to split $X$ into two parts $f(X)$ and $g(X)$ such that neither part is sufficient to reconstruct $X$ by itself, but both together can recover $X$ fully, and the joint distribution of $(f(X),g(X))$ is tractable? As one example, if $X=(X_1,\dots,X_n)$ and $P$ is a product distribution, then for any $m<n$, we can split the sample to define $f(X)=(X_1,\dots,X_m)$ and $g(X)=(X_{m+1},\dots,X_n)$. Rasines and Young (2021) offers an alternative route of accomplishing this task through randomization of $X$ with additive Gaussian noise which enables post-selection inference in finite samples for Gaussian distributed data and asymptotically for non-Gaussian additive models. In this paper, we offer a more general methodology for achieving such a split in finite samples by borrowing ideas from Bayesian inference to yield a (frequentist) solution that can be viewed as a continuous analog of data splitting. We call our method data fission, as an alternative to data splitting, data carving and p-value masking. We exemplify the method on a few prototypical applications, such as post-selection inference for trend filtering and other regression problems.

The autoregressive moving average (ARMA) model is a classical, and arguably one of the most studied approaches to model time series data. It has compelling theoretical properties and is widely used among practitioners. More recent deep learning approaches popularize recurrent neural networks (RNNs) and, in particular, long short-term memory (LSTM) cells that have become one of the best performing and most common building blocks in neural time series modeling. While advantageous for time series data or sequences with long-term effects, complex RNN cells are not always a must and can sometimes even be inferior to simpler recurrent approaches. In this work, we introduce the ARMA cell, a simpler, modular, and effective approach for time series modeling in neural networks. This cell can be used in any neural network architecture where recurrent structures are present and naturally handles multivariate time series using vector autoregression. We also introduce the ConvARMA cell as a natural successor for spatially-correlated time series. Our experiments show that the proposed methodology is competitive with popular alternatives in terms of performance while being more robust and compelling due to its simplicity.

Regularized methods have been widely applied to system identification problems without known model structures. This paper proposes an infinite-dimensional sparse learning algorithm based on atomic norm regularization. Atomic norm regularization decomposes the transfer function into first-order atomic models and solves a group lasso problem that selects a sparse set of poles and identifies the corresponding coefficients. The difficulty in solving the problem lies in the fact that there are an infinite number of possible atomic models. This work proposes a greedy algorithm that generates new candidate atomic models maximizing the violation of the optimality condition of the existing problem. This algorithm is able to solve the infinite-dimensional group lasso problem with high precision. The algorithm is further extended to reduce the bias and reject false positives in pole location estimation by iteratively reweighted adaptive group lasso and complementary pairs stability selection respectively. Numerical results demonstrate that the proposed algorithm performs better than benchmark parameterized and regularized methods in terms of both impulse response fitting and pole location estimation.  ( 2 min )

High-dimensional models often have a large memory footprint and must be quantized after training before being deployed on resource-constrained edge devices for inference tasks. In this work, we develop an information-theoretic framework for the problem of quantizing a linear regressor learned from training data $(\mathbf{X}, \mathbf{y})$, for some underlying statistical relationship $\mathbf{y} = \mathbf{X}\boldsymbol{\theta} + \mathbf{v}$. The learned model, which is an estimate of the latent parameter $\boldsymbol{\theta} \in \mathbb{R}^d$, is constrained to be representable using only $Bd$ bits, where $B \in (0, \infty)$ is a pre-specified budget and $d$ is the dimension. We derive an information-theoretic lower bound for the minimax risk under this setting and propose a matching upper bound using randomized embedding-based algorithms which is tight up to constant factors. The lower and upper bounds together characterize the minimum threshold bit-budget required to achieve a performance risk comparable to the unquantized setting. We also propose randomized Hadamard embeddings that are computationally efficient and are optimal up to a mild logarithmic factor of the lower bound. Our model quantization strategy can be generalized and we show its efficacy by extending the method and upper-bounds to two-layer ReLU neural networks for non-linear regression. Numerical simulations show the improved performance of our proposed scheme as well as its closeness to the lower bound.  ( 3 min )

There has been an intense recent activity in embedding of very high dimensional and nonlinear data structures, much of it in the data science and machine learning literature. We survey this activity in four parts. In the first part we cover nonlinear methods such as principal curves, multidimensional scaling, local linear methods, ISOMAP, graph based methods and diffusion mapping, kernel based methods and random projections. The second part is concerned with topological embedding methods, in particular mapping topological properties into persistence diagrams and the Mapper algorithm. Another type of data sets with a tremendous growth is very high-dimensional network data. The task considered in part three is how to embed such data in a vector space of moderate dimension to make the data amenable to traditional techniques such as cluster and classification techniques. Arguably this is the part where the contrast between algorithmic machine learning methods and statistical modeling, the so-called stochastic block modeling, is at its greatest. In the paper, we discuss the pros and cons for the two approaches. The final part of the survey deals with embedding in $\mathbb{R}^ 2$, i.e. visualization. Three methods are presented: $t$-SNE, UMAP and LargeVis based on methods in parts one, two and three, respectively. The methods are illustrated and compared on two simulated data sets; one consisting of a triplet of noisy Ranunculoid curves, and one consisting of networks of increasing complexity generated with stochastic block models and with two types of nodes.  ( 3 min )

Deployment efficiency is an important criterion for many real-world applications of reinforcement learning (RL). Despite the community's increasing interest, there lacks a formal theoretical formulation for the problem. In this paper, we propose such a formulation for deployment-efficient RL (DE-RL) from an "optimization with constraints" perspective: we are interested in exploring an MDP and obtaining a near-optimal policy within minimal \emph{deployment complexity}, whereas in each deployment the policy can sample a large batch of data. Using finite-horizon linear MDPs as a concrete structural model, we reveal the fundamental limit in achieving deployment efficiency by establishing information-theoretic lower bounds, and provide algorithms that achieve the optimal deployment efficiency. Moreover, our formulation for DE-RL is flexible and can serve as a building block for other practically relevant settings; we give "Safe DE-RL" and "Sample-Efficient DE-RL" as two examples, which may be worth future investigation.  ( 2 min )

This paper introduces a new type of causal structure, namely multiscale non-stationary directed acyclic graph (MN-DAG), that generalizes DAGs to the time-frequency domain. Our contribution is twofold. First, by leveraging results from spectral and causality theories, we expose a novel probabilistic generative model, which allows to sample an MN-DAG according to user-specified priors concerning the time-dependence and multiscale properties of the causal graph. Second, we devise a Bayesian method for the estimation of MN-DAGs, by means of stochastic variational inference (SVI), called Multiscale Non-Stationary Causal Structure Learner (MN-CASTLE). In addition to direct observations, MN-CASTLE exploits information from the decomposition of the total power spectrum of time series over different time resolutions. In our experiments, we first use the proposed model to generate synthetic data according to a latent MN-DAG, showing that the data generated reproduces well-known features of time series in different domains. Then we compare our learning method MN-CASTLE against baseline models on synthetic data generated with different multiscale and non-stationary settings, confirming the good performance of MN-CASTLE. Finally, we show some insights derived from the application of MN-CASTLE to study the causal structure of 7 global equity markets during the Covid-19 pandemic.  ( 3 min )

In object detection, data amount and cost are a trade-off, and collecting a large amount of data in a specific domain is labor intensive. Therefore, existing large-scale datasets are used for pre-training. However, conventional transfer learning and domain adaptation cannot bridge the domain gap when the target domain differs significantly from the source domain. We propose a data synthesis method that can solve the large domain gap problem. In this method, a part of the target image is pasted onto the source image, and the position of the pasted region is aligned by utilizing the information of the object bounding box. In addition, we introduce adversarial learning to discriminate whether the original or the pasted regions. The proposed method trains on a large number of source images and a few target domain images. The proposed method achieves higher accuracy than conventional methods in a very different domain problem setting, where RGB images are the source domain, and thermal infrared images are the target domain. Similarly, the proposed method achieves higher accuracy in the cases of simulation images to real images.  ( 2 min )

Normalizing flows model a complex target distribution in terms of a bijective transform operating on a simple base distribution. As such, they enable tractable computation of a number of important statistical quantities, particularly likelihoods and samples. Despite these appealing properties, the computation of more complex inference tasks, such as the cumulative distribution function (CDF) over a complex region (e.g., a polytope) remains challenging. Traditional CDF approximations using Monte-Carlo techniques are unbiased but have unbounded variance and low sample efficiency. Instead, we build upon the diffeomorphic properties of normalizing flows and leverage the divergence theorem to estimate the CDF over a closed region in target space in terms of the flux across its \emph{boundary}, as induced by the normalizing flow. We describe both deterministic and stochastic instances of this estimator: while the deterministic variant iteratively improves the estimate by strategically subdividing the boundary, the stochastic variant provides unbiased estimates. Our experiments on popular flow architectures and UCI benchmark datasets show a marked improvement in sample efficiency as compared to traditional estimators.  ( 2 min )

Multi-view data are commonly encountered in data mining applications. Effective extraction of information from multi-view data requires specific design of clustering methods to cater for data with multiple views, which is non-trivial and challenging. In this paper, we propose a novel one-step multi-view clustering method by exploiting the dual representation of both the common and specific information of different views. The motivation originates from the rationale that multi-view data contain not only the consistent knowledge between views but also the unique knowledge of each view. Meanwhile, to make the representation learning more specific to the clustering task, a one-step learning framework is proposed to integrate representation learning and clustering partition as a whole. With this framework, the representation learning and clustering partition mutually benefit each other, which effectively improve the clustering performance. Results from extensive experiments conducted on benchmark multi-view datasets clearly demonstrate the superiority of the proposed method.  ( 2 min )

We consider the community detection problem in sparse random hypergraphs under the non-uniform hypergraph stochastic block model (HSBM), a general model of random networks with community structure and higher-order interactions. When the random hypergraph has bounded expected degrees, we provide a spectral algorithm that outputs a partition with at least a $\gamma$ fraction of the vertices classified correctly, where $\gamma\in (0.5,1)$ depends on the signal-to-noise ratio (SNR) of the model. When the SNR grows slowly as the number of vertices goes to infinity, our algorithm achieves weak consistency, which improves the previous results in Ghoshdastidar and Dukkipati (2017) for non-uniform HSBMs. Our spectral algorithm consists of three major steps: (1) Hyperedge selection: select hyperedges of certain sizes to provide the maximal signal-to-noise ratio for the induced sub-hypergraph; (2) Spectral partition: construct a regularized adjacency matrix and obtain an approximate partition based on singular vectors; (3) Correction and merging: incorporate the hyperedge information from adjacency tensors to upgrade the error rate guarantee. The theoretical analysis of our algorithm relies on the concentration and regularization of the adjacency matrix for sparse non-uniform random hypergraphs, which can be of independent interest.  ( 2 min )

In this paper we propose a three stages analysis of the evolution of Covid19 in Romania. There are two main issues when it comes to pandemic prediction. The first one is the fact that the numbers reported of infected and recovered are unreliable, however the number of deaths is more accurate. The second issue is that there were many factors which affected the evolution of the pandemic. In this paper we propose an analysis in three stages. The first stage is based on the classical SIR model which we do using a neural network. This provides a first set of daily parameters. In the second stage we propose a refinement of the SIR model in which we separate the deceased into a distinct category. By using the first estimate and a grid search, we give a daily estimation of the parameters. The third stage is used to define a notion of turning points (local extremes) for the parameters. We call a regime the time between these points. We outline a general way based on time varying parameters of SIRD to make predictions.  ( 3 min )

A primary goal of computer experiments is to reconstruct the function given by the computer code via scattered evaluations. Traditional isotropic Gaussian process models suffer from the curse of dimensionality, when the input dimension is relatively high given limited data points. Gaussian process models with additive correlation functions are scalable to dimensionality, but they are more restrictive as they only work for additive functions. In this work, we consider a projection pursuit model, in which the nonparametric part is driven by an additive Gaussian process regression. We choose the dimension of the additive function higher than the original input dimension, and call this strategy "dimension expansion". We show that dimension expansion can help approximate more complex functions. A gradient descent algorithm is proposed for model training based on the maximum likelihood estimation. Simulation studies show that the proposed method outperforms the traditional Gaussian process models. The Supplementary Materials are available online.  ( 2 min )

Recovering underlying Directed Acyclic Graph structures (DAG) from observational data is highly challenging due to the combinatorial nature of the DAG-constrained optimization problem. Recently, DAG learning has been cast as a continuous optimization problem by characterizing the DAG constraint as a smooth equality one, generally based on polynomials over adjacency matrices. Existing methods place very small coefficients on high-order polynomial terms for stabilization, since they argue that large coefficients on the higher-order terms are harmful due to numeric exploding. On the contrary, we discover that large coefficients on higher-order terms are beneficial for DAG learning, when the spectral radiuses of the adjacency matrices are small, and that larger coefficients for higher-order terms can approximate the DAG constraints much better than the small counterparts. Based on this, we propose a novel DAG learning method with efficient truncated matrix power iteration to approximate geometric series-based DAG constraints. Empirically, our DAG learning method outperforms the previous state-of-the-arts in various settings, often by a factor of 3 or more in terms of structural Hamming distance.  ( 2 min )

Network data are commonly collected in a variety of applications, representing either directly measured or statistically inferred connections between features of interest. In an increasing number of domains, these networks are collected over time, such as interactions between users of a social media platform on different days, or across multiple subjects, such as in multi-subject studies of brain connectivity. When analyzing multiple large networks, dimensionality reduction techniques are often used to embed networks in a more tractable low-dimensional space. To this end, we develop a framework for principal components analysis (PCA) on collections of networks via a specialized tensor decomposition we term Semi-Symmetric Tensor PCA or SS-TPCA. We derive computationally efficient algorithms for computing our proposed SS-TPCA decomposition and establish statistical efficiency of our approach under a standard low-rank signal plus noise model. Remarkably, we show that SS-TPCA achieves the same estimation accuracy as classical matrix PCA, with error proportional to the square root of the number of vertices in the network and not the number of edges as might be expected. Our framework inherits many of the strengths of classical PCA and is suitable for a wide range of unsupervised learning tasks, including identifying principal networks, isolating meaningful changepoints or outlying observations, and for characterizing the "variability network" of the most varying edges. Finally, we demonstrate the effectiveness of our proposal on simulated data and on an example from empirical legal studies. The techniques used to establish our main consistency results are surprisingly straightforward and may find use in a variety of other network analysis problems.  ( 3 min )

Learning curves plot the expected error of a learning algorithm as a function of the number of labeled input samples. They are widely used by machine learning practitioners as a measure of an algorithm's performance, but classic PAC learning theory cannot explain their behavior. In this paper we introduce a new combinatorial characterization called the VCL dimension that improves and refines the recent results of Bousquet et al. (2021). Our characterization sheds new light on the structure of learning curves by providing fine-grained bounds, and showing that for classes with finite VCL, the rate of decay can be decomposed into a linear component that depends only on the hypothesis class and an exponential component that depends also on the target distribution. In particular, the finer nuance of the VCL dimension implies lower bounds that are quantitatively stronger than the bounds of Bousquet et al. (2021) and qualitatively stronger than classic 'no free lunch' lower bounds. The VCL characterization solves an open problem studied by Antos and Lugosi (1998), who asked in what cases such lower bounds exist. As a corollary, we recover their lower bound for half-spaces in $\mathbb{R}^d$, and we do so in a principled way that should be applicable to other cases as well. Finally, to provide another viewpoint on our work and how it compares to traditional PAC learning bounds, we also present an alternative formulation of our results in a language that is closer to the PAC setting.  ( 3 min )

Positive-unlabeled (PU) learning aims at learning a binary classifier from only positive and unlabeled training data. Recent approaches addressed this problem via cost-sensitive learning by developing unbiased loss functions, and their performance was later improved by iterative pseudo-labeling solutions. However, such two-step procedures are vulnerable to incorrectly estimated pseudo-labels, as errors are propagated in later iterations when a new model is trained on erroneous predictions. To prevent such confirmation bias, we propose PUUPL, a novel loss-agnostic training procedure for PU learning that incorporates epistemic uncertainty in pseudo-label selection. By using an ensemble of neural networks and assigning pseudo-labels based on low-uncertainty predictions, we show that PUUPL improves the reliability of pseudo-labels, increasing the predictive performance of our method and leading to new state-of-the-art results in self-training for PU learning. With extensive experiments, we show the effectiveness of our method over different datasets, modalities, and learning tasks, as well as improved calibration, robustness over prior misspecifications, biased positive data, and imbalanced datasets.  ( 2 min )

We consider the use of Gaussian process (GP) priors for solving inverse problems in a Bayesian framework. As is well known, the computational complexity of GPs scales cubically in the number of datapoints. We here show that in the context of inverse problems involving integral operators, one faces additional difficulties that hinder inversion on large grids. Furthermore, in that context, covariance matrices can become too large to be stored. By leveraging results about sequential disintegrations of Gaussian measures, we are able to introduce an implicit representation of posterior covariance matrices that reduces the memory footprint by only storing low rank intermediate matrices, while allowing individual elements to be accessed on-the-fly without needing to build full posterior covariance matrices. Moreover, it allows for fast sequential inclusion of new observations. These features are crucial when considering sequential experimental design tasks. We demonstrate our approach by computing sequential data collection plans for excursion set recovery for a gravimetric inverse problem, where the goal is to provide fine resolution estimates of high density regions inside the Stromboli volcano, Italy. Sequential data collection plans are computed by extending the weighted integrated variance reduction (wIVR) criterion to inverse problems. Our results show that this criterion is able to significantly reduce the uncertainty on the excursion volume, reaching close to minimal levels of residual uncertainty. Overall, our techniques allow the advantages of probabilistic models to be brought to bear on large-scale inverse problems arising in the natural sciences.  ( 3 min )

The alternating current (AC) chance-constrained optimal power flow (CC-OPF) problem addresses the economic efficiency of electricity generation and delivery under generation uncertainty. The latter is intrinsic to modern power grids because of the high amount of renewables. Despite its academic success, the AC CC-OPF problem is highly nonlinear and computationally demanding, which limits its practical impact. For improving the AC-OPF problem complexity/accuracy trade-off, the paper proposes a fast data-driven setup that uses the sparse and hybrid Gaussian processes (GP) framework to model the power flow equations with input uncertainty. We advocate the efficiency of the proposed approach by a numerical study over multiple IEEE test cases showing up to two times faster and more accurate solutions compared to the state-of-the-art methods.  ( 2 min )

We prove the familiar Lazy Online Gradient Descent algorithm is universal on polytope domains. That means it gets $O(1)$ pseudo-regret against i.i.d opponents, while simultaneously achieving the well-known $O(\sqrt N)$ worst-case regret bound. For comparison the bulk of the literature focuses on variants of the Hedge (exponential weights) algorithm on the simplex. These can in principle be lifted to general polytopes; however the process is computationally unfeasible for many important classes where the number of vertices grows quickly with the dimension. The lifting procedure also ignores any Euclidean bounds on the cost vectors, and can create extra factors of dimension in the pseudo-regret bound. Gradient Descent is simpler than the handful of purpose-built algorithms for polytopes in the literature, and works in a broader setting. In particular existing algorithms assume the optimiser is unique, while our bound allows for several optimal vertices.  ( 2 min )

Hi guys Im trying to use xgboost for quantile regression, and I've seen and tried few scripts that have modified objective functions. They are, however, prepared and tested for single output predictions. As a result, something breaks (i think its because of 2 dimensional prediction/test data. So far my modifications haven't been fruitful. I'm wondering whether anyone has used quantial multioutput regression, and if yes, what was your Setup like thank you for attention ] submitted by /u/ncuxomun [link] [comments]  ( 88 min )

I have read an interesting article https://sigbed.org/2022/08/22/the-toxic-culture-of-rejection-in-computer-science/ . It says that the high rejection rate cannot help the community. It is true to reject some papers to guarantee quality. However, the current rejection ratio is too high such that many papers are rejected for trival reasons (e.g. lack of novelty). I have personally received many rejections due to no reason (they just want to control the ratio to make them looks highly selective). I think currently, due to too many submissions, the reviewer team cannot pick really "good" papers within a very limited acceptance ratio. submitted by /u/singularpanda [link] [comments]  ( 109 min )

According to this SEC filing, the US government has instituted a new license requirement for exports to China or Russia of any NVIDIA GPUs that are as good or better than the A100. The motivation is supposedly to prevent possible military uses. Seems the collateral damage could be a blow to Chinese ML research moving forward, considering the massive reliance on NVIDIA GPUs currently: The Company’s outlook for its third fiscal quarter provided on August 24, 2022 included approximately $400 million in potential sales to China which may be subject to the new license requirement if customers do not want to purchase the Company’s alternative product offerings or if the USG does not grant licenses in a timely manner or denies licenses to significant customers. submitted by /u/dojoteef [link] [comments]  ( 91 min )

I'm experimenting with some image and video ML models and I'm not sure where to find good labelled or annotated data. Please share any resources you know of. Willing to pay, but would prefer something inexpensive or free if it's available! submitted by /u/memorycardfull [link] [comments]  ( 88 min )

Some cases for "the same or different" (because every object is technically different from another in some way, so specific cases must be made) could be car make and models, people, satellite images of the same location etc. Generally whats a good place to look for an answer to such a problem if there is no specific model out there? submitted by /u/UncleSammmm [link] [comments]  ( 88 min )

Paper: https://arxiv.org/abs/2208.14271 Abstract: Although contemporary large language models (LMs) demonstrate impressive question-answering capabilities, their answers are typically the product of a single call to the model. This entails an unwelcome degree of opacity and compromises performance, especially on problems that are inherently multi-step. To address these limitations, we show how LMs can be made to perform faithful multi-step reasoning via a process whose causal structure mirrors the underlying logical structure of the problem. Our approach works by chaining together reasoning steps, where each step results from calls to two fine-tuned LMs, one for selection and one for inference, to produce a valid reasoning trace. Our method carries out a beam search through the space of reasoning traces to improve reasoning quality. We demonstrate the effectiveness of our model on multi-step logical deduction and scientific question-answering, showing that it outperforms baselines on final answer accuracy, and generates humanly interpretable reasoning traces whose validity can be checked by the user. https://preview.redd.it/cn9wutrwz3l91.jpg?width=938&format=pjpg&auto=webp&s=46af908a212ef92f2409c1d9e595f9e7542407c3 https://preview.redd.it/w4s6kerwz3l91.jpg?width=1294&format=pjpg&auto=webp&s=9c22997d7c92f281eb0a1fcec7a6cc39c524653e https://preview.redd.it/gpxyrerwz3l91.jpg?width=509&format=pjpg&auto=webp&s=46900894e0495253fea372abb73ca5da376185ac https://preview.redd.it/s3soierwz3l91.jpg?width=912&format=pjpg&auto=webp&s=5f88da0b0a0e187d886f255156d49b562975c97b https://preview.redd.it/qxgrifrwz3l91.jpg?width=670&format=pjpg&auto=webp&s=534dd5cac6d810cfe772f643eeacd4fdc987e198 https://preview.redd.it/d1dt3n3c04l91.jpg?width=1069&format=pjpg&auto=webp&s=e0f889cbdc3a43b15e820cba0b62b25a8a4b0933 https://preview.redd.it/dnbvyerwz3l91.jpg?width=1417&format=pjpg&auto=webp&s=b8e66f05296780ddb6b4beaa704ff6829ec80de7 submitted by /u/Singularian2501 [link] [comments]  ( 89 min )

Hello r/MachineLearning !! We have rebranded!! Introducing… drumroll… 🤖 LITTLE LEARNING MACHINES 🤖 (Formerly: Animo Island) The reinforcement learning game where you train cute AI robots with love and fear to do all sorts of actions! With unlimited possibilities, you can train your little machine to do nearly anything. In our cozy artificial life simulator YOU experiment with the power of A.I. and reinforcement learning, your little robots are actually learning from their wins and their mistakes making no two machines alike. We are excited to be back on Reddit and can't wait to see all of the cool projects you are working on! And what do you all think of our new logo? PS. Currently working on getting our Steam page up and running so keep your eyes peeled this week! 👀 https://i.redd.it/l2l165es04l91.gif submitted by /u/LoveFearLearn [link] [comments]  ( 89 min )

Here's a link to the post discussing this topic - https://exafunction.com/blog/are-gpus-worth-it At Exafunction, we've noticed a lot of companies CPUs for machine learning inference workloads. We wrote this post to add some color on this and explain why generally GPUs, if managed properly, are the right hardware for these workloads. submitted by /u/varunkmohan [link] [comments]  ( 88 min )

Hello all, I'm working on a machine learning/datascience project. I thought to myself, why should Meta and Google hoard and sell all my data when that benefits me nothing? So I thought I'd use my skills in machine learning and take matters into my own hands. I'd like to log every piece of data that goes into my PC and phone. Web browser history, keystrokes, chats, content of web pages, screenshots, mouse movements. I'm very interested in what I could learn from this. And I'd have a detailed diary of my life so that in twenty years I can go back and know exactly what I did that day. What do you guys think is worth logging and what could I do with this data? submitted by /u/PMMEYOURSMIL3 [link] [comments]  ( 91 min )

Hi there, Happy wonderful Wednesday! I had a quick question I was hoping the community could help with some personal stories or suggestions? I'm trying to figure out what's considered the best NLP technique or algo when you want to find all the words associated with a term across posts. For example: Say we have the sentence: "the treatment has been rather difficult because I've experienced some horrible side effects such as headaches". Now we want to figure out what someone thinks about the treatment, the answer should be difficult. I've had a lot of great results using dependency parsing but wanted to know if there were any other really great techniques that I haven't tried, maybe BERT, Word2Vec etc. Thank you very much and all the best, N submitted by /u/Gyllenspetz [link] [comments]  ( 108 min )

Hey guys, I'm currently in the process of writing an ML paper, and I hesitate for the title of my paper between a factual neutral title and a more catchy one. One of my options is the title: "One graph to solve them all" which is a direct reference to lord of the rings. The fact is that this title fits perfectly with the subject of the paper. However, I don't want to follow the line of random papers that have taken over the name of known papers. ( ex: -My niche concept that nobody will never heard of- is all you need ... ) What do you think of these kinds of titles? do you consider that research should remain as much neutral as possible ? submitted by /u/Zealousideal-Ice9957 [link] [comments]  ( 90 min )

Different methods can be used for this complex task. Most of them use machine learning, deep and neural networks. Usually, one big problem is working with imbalanced datasets. Some algorithms such as Smote and Adasyn could resolve the data skewness. One very important aspect of fraud detection is model explainability and rule extraction from the trained model. Here I show how to apply these concepts to real data. https://medium.com/data-reply-it-datatech/imbalanced-classification-in-fraud-detection-8f63474ff8c7 For you which is the best approach? How important is a model like that? Let's discuss it. https://preview.redd.it/fver03haf2l91.jpg?width=840&format=pjpg&auto=webp&s=830a60b0f45ffc216a622d92b2f00d719adf8827 submitted by /u/AlexRava7 [link] [comments]  ( 88 min )

In a naive ML project one might split the dataset into train - test to train a model and get a sense of its performance, either during or after training. The problem arises when you want to improve the model continuously. The test set will no longer give an unbiased measure of model performance since you have improved your model to achieve as good a performance as possible on the test set. So we introduce the validation set (dataset -> train, validation, test). Now we can continuously improve our model, evaluate performance on the validation set as much as we want and once we feel happy we will evaluate on the test set. Except we realize we actually wanted to improve the model further a few times. To confirm that the new model is better we also inference on the test set. After all, we would not want to put our new model in production if it performs worse on the test set compared to the old model would we? So the test set once again influences our model selection/development and will therefore be biased. We can introduce a fourth partition, or a fifth to test more seldom on more and more unbiased data after iterative development on the previous partitions. One solution could be to perform k-fold or nested cross validation, but as you continuously want to improve your models after having used the test data, the test samples will once again have been used to select the final model. We want unbiased results when evaluating and comparing models, but comparing models multiple times to select the best one will make our data biased. Is this truly a dichotomy? submitted by /u/zimonitrome [link] [comments]  ( 92 min )

Hi, I recently discovered that stable diffusion img2img can be used for designing interfaces, which could be interesting in human computer interaction. Any other interesting projects that can be used in scientific research and HCI? submitted by /u/Flippynips987 [link] [comments]  ( 88 min )

BLS/BLA Classifier Model is getting trained, post which it’s getting terminated with a timeout error without displaying results (running with WSGI and gunicorn). When the model is executed with a single file of inputs in a standalone mode without gunicorn, the model is displaying the desired results. But when the model is executed with gunicorn, it’s getting abruptly terminated without printing the results. The Error which we get is as follows: Timeout Error from Log (Screenshot/Snippet): PostMAN : https://preview.redd.it/h8e0l57tw1l91.png?width=1495&format=png&auto=webp&s=f95ee82f6bcdd743fea3979092f07f11c61b791f Gunicorn std_err: https://preview.redd.it/y9b14tkvw1l91.png?width=1919&format=png&auto=webp&s=c6f0d95731d5473566c18a66cf46e1916246bf7b submitted by /u/ActualRecover1639 [link] [comments]  ( 88 min )

Model fine-tuning allows you to improve the quality of the pre-trained models with just a fraction of the resources spent on training the original model. We've run several experiments to test the number of layers to fine-tune. Here are the results: https://qdrant.tech/articles/embedding-recycler/ There is a trade-off between the number of layers you tune and the precision you get. Using fewer layers allows for faster training with a larger batch size, while more layers increase the model's capacity. Highlights from the experiments: 1. Training only the head of a model (5% of weights) gives a 2x boost on metrics, while full training—only 3x. 2. Training only a head layer allows using larger models with bigger batch sizes, compensating for the precision. 3. If you only have a small dataset, full model tuning will give a more negligible effect. submitted by /u/devzaya [link] [comments]  ( 106 min )

Hello, I’m actually writing a paper and I ´m looking for a website than help me do Machine learning figures. Any suggestions ? submitted by /u/Meddhouib10 [link] [comments]  ( 90 min )

Hi there, it's Lewis from the open-source team at Hugging Face 👋 I'm heaps stoked to share a project we've been working on to enable large-scale evaluation of over 65k models on the Hugging Face Hub 🤯! Evaluation on the Hub provides a tool to evaluate models directly from the Hub, as well as leaderboards to quickly find the best performing models: ​ Model evaluator: https://huggingface.co/spaces/autoevaluate/model-evaluator?dataset=glue Leaderboards: https://huggingface.co/spaces/autoevaluate/leaderboards?dataset=glue You can also reach these tools directly from buttons provide on every dataset pages on the Hub: https://preview.redd.it/cl5iaf8ua1l91.png?width=2698&format=png&auto=webp&s=0683edb0a95626472ac3fc66dac95daa557ef961 We've just added support for all GLUE tasks like MNLI and MRPC, and we also support computer vision tasks like image classification. You can find more details in the blog post from the launch: https://huggingface.co/blog/eval-on-the-hub We'd love to hear what the community thinks about this feature (or what an evaluation wish list would look like) - feel free to drop a comment below! submitted by /u/lewtun [link] [comments]  ( 90 min )

(https://arxiv.org/abs/2206.15475) Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This perspective enables us to reason about the effects of changes to this process (interventions) and what would have happened in hindsight (counterfactuals). We categorize work in CausalML into five groups according to the problems they address: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, and (5) causal reinforcement learning. We systematically compare the methods in each category and point out open problems. Further, we review data-modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work. ​ Here's a link to our website, and tweet https://www.causal-machine-learning.com/ https://twitter.com/aengus_lynch1/status/1558128460102602757 submitted by /u/its_the_goose [link] [comments]  ( 89 min )

Hello everyone, I am currently looking at creating a false alert filtering and intelligent detection software for security cameras. This object detection software that can look at pictures in near real time and filter them (keeping only human and vehicles). Basic flow: Security cameras generate 30-second intrusion detection, line crossing, and loitering alerts These alerts are saved in different folders based on source location Sparse images are taken out of each alert, video is discarded Object detection and classification tool runs, remove all false alerts, leaving only humans and vehicles, saving one image per alert, all others are deleted Based on ruleset for that particular source location/folder further detection is done (no PPE, restricted area, wearing shorts, generator off, water present, light flashing, etc.) Results are stored in a database and displayed in a GUI showing all incoming alerts categorized by source location, alert type and object detected Alert videos are generated by outdoor security cameras installed at construction sites, malls, warehouses, parking lots, etc. (about 3,000 cameras and growing). We have over a million actual and relevant images saved that can be used to train the model. I have figured out everything else and have been doing some research on OpenCV, YOLOV7, Detectron2, etc. and would love to get some guidance on selecting the best framework and tools from experienced members for the object detection and categorization. Any and all advice is appreciated. Thanks a bunch in advance submitted by /u/DesignerWatercress99 [link] [comments]  ( 93 min )

Thinking about GPT-3 In-Context Learning for Biomedical IE? Think Again TL;DR: GPT-3 few-shot (100 examples) performed worse than supervised "small"-size transformers (BERT, RoBERTa) on named-entity recognition and relation extraction in the biomedical domain. A few additional issues I can see with using LLM for classification include: Temperature (and other hyper parameters) need to be tuned. This requires additional (albeit small) validation set, so no longer actual zero-shot classification. The obscurity of the association between prompt design and output make it a trial-and-error ("black art") process, again requiring additional training data. Essentially we replace data labeling with prompt designing. Efficiency: often classification is used for "needle in a haystack" goals (to avoid the cost of human effort). LLM are expensive and can easily reach $50-100K for running the classifier on a production population. If many prompts are needed (as in the article), this adds up to the token-based pricing of the model. Any real-world experience/input on using GPT-3 et al for classification? submitted by /u/CacheMeUp [link] [comments]  ( 89 min )

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GPUs are designed to accelerate machine learning computations while simultaneously reducing latency and costs for training models and running inferences for production ML. While they are optimized to quickly process large workloads, unless they are managed efficiently, they can quickly drive up your consumption costs. This tech talk will explore how you can efficiently use GPU resources for production inferences. We'll walk through some of the common approaches and potential pitfalls with using GPUs, and help you identify the most efficient and cost effective method to meet your team's needs and resources. Thursday Sept 1 at 12:30PM EDT in Discord submitted by /u/modzykirsten [link] [comments]  ( 92 min )

Check out Space Channel's new AI-enhanced Digital News report from Brynly Mac on the Artemis 1 launch delay. Artemis 1 Launch Scrubbed. Will it launch this Saturday? submitted by /u/Space_Channel_FDIR [link] [comments]  ( 87 min )

I want to create an application which can detect malnutrition in children. Technically, the app can capture and measure the child's height, body volume, and weight ratio by using an infrared sensor that creates a 3D scan of a child. And based from that data, the AI can detect whether someone is malnourished or not. If malnourished, it will recommend the suitable and the variety of food items that the child can have. I was wondering if this is feasible. What are the initials steps I should take? submitted by /u/eudaimoniclux [link] [comments]  ( 87 min )

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Hey everyone, today I published 1st video regarding "How you can perform neural Architecture Search without training". Do checkout the video. https://www.youtube.com/watch?v=5Iw9pPdXPzI submitted by /u/nightstorm1990 [link] [comments]  ( 92 min )

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Hi everyone, I’m part of the Memri team that’s building an open source a machine learning pipeline that makes it easier for you to create data apps you can instantly use. Think building a sentiment analysis app for your own whatsapp chats, while your privacy is protected and you control the algorithms, so you can fully trust your data isn't being misused. We’re trying to learn more about what’s the most annoying when applying ML so we can try to make that easier for everyone who’s interested in ML. TLDR: What improvements to any ML-pipeline would make your ML-life muuuuch easier? ps; If you want be informed about our alpha and just play around with what we have already you could Sign up for updates here or have a look at our [Discord] (https://discord.com/invite/kRTcDtGUmr) or website if you want to learn more. submitted by /u/BLECQ1 [link] [comments]  ( 87 min )

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I am fascinated by how an AI art generator like this can't get fingers and toes right. Does anyone have an explanation for this? submitted by /u/HelpfulAmoeba [link] [comments]  ( 87 min )

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Hello r/reinforcementlearning !! We have rebranded!! Introducing… drumroll… 🤖 LITTLE LEARNING MACHINES 🤖 (Formerly: Animo Island) The reinforcement learning game where you train cute AI robots with love and fear to do all sorts of actions! With unlimited possibilities, you can train your little machine to do nearly anything. In our cozy artificial life simulator YOU experiment with the power of A.I. and reinforcement learning, your little robots are actually learning from their wins and their mistakes making no two machines alike. We are excited to be back on Reddit and can't wait to see all of the cool projects you are working on! And what do you all think of our new logo? PS. Currently working on getting our Steam page up and running so keep your eyes peeled this week! 👀 https://i.redd.it/ssdy5mma04l91.gif submitted by /u/LoveFearLearn [link] [comments]  ( 87 min )

More and more people seem to use / try out Jax. For example CleanRL has some implementation in Jax now. I also tried to code PPO, DQN etc. in Jax. The speed up is really nice but I'm wondering if anyone tried out doing the same (jitting the learning procedure) with TorchScript. If so, what were your results? submitted by /u/NiconiusX [link] [comments]  ( 87 min )

The main argument for off-policy algorithms is usually sample efficiency, and perhaps a robustness argument about agents being able to escape local minima by learning from a wider range of experience. The consensus I get is, there’s no reason why you would want to use on-policy learning if you can find a way to stabilize off-policy learning. Are there any pros to on-policy learning? If we could find a way to make on-policy learning more sample efficient, is there a reason why we’d want to use it over off-policy methods? submitted by /u/vandelay_inds [link] [comments]  ( 88 min )

I was wondering if there were any RL-focused newspapers that summarise recent research and developments in the field? If not, how many of you would be interested in following such a newspaper? submitted by /u/nacho_rz [link] [comments]  ( 95 min )

Posted Grigor Aslanyan, Software Engineer, Google Patent documents typically use legal and highly technical language, with context-dependent terms that may have meanings quite different from colloquial usage and even between different documents. The process of using traditional patent search methods (e.g., keyword searching) to search through the corpus of over one hundred million patent documents can be tedious and result in many missed results due to the broad and non-standard language used. For example, a "soccer ball" may be described as a "spherical recreation device", "inflatable sportsball" or "ball for ball game". Additionally, the language used in some patent documents may obfuscate terms to their advantage, so more powerful natural language processing (NLP) and semantic similari…  ( 26 min )

Extend creativity and tell a bigger story with DALL-E images of any size Original outpainting by Emma Catnip Today we’re introducing Outpainting, a new feature which helps users extend their creativity by continuing an image beyond its original borders — adding visual elements in the same style, or  ( 4 min )

Joseph Fraunhofer was a 19th-century pioneer in optics who brought together scientific research with industrial applications. Fast forward to today and Germany’s Fraunhofer Society — Europe’s largest R&D organization — is setting its sights on the applied research of key technologies, from AI to cybersecurity to medicine. Its Fraunhofer IML unit is aiming to push Read article > The post Fraunhofer Research Leads Way Into Future of Robotics appeared first on NVIDIA Blog.  ( 5 min )

NVIDIA is collaborating with the United Nations Economic Commission for Africa (UNECA) to equip governments and developer communities in 10 nations with data science training and technology to support more informed policymaking and accelerate how resources are allocated. The initiative will empower the countries’ national statistical offices — agencies that handle population censuses data, economic Read article > The post UN Economic Commission for Africa Engages NVIDIA to Boost Data Science in 10 Nations appeared first on NVIDIA Blog.  ( 6 min )

In the NVIDIA Studio celebrates the Open Broadcaster Software (OBS) Studio’s 10th anniversary and its 28.0 software release. Plus, popular streamer WATCHHOLLIE shares how she uses OBS and a GeForce RTX 3080 GPU in a single-PC setup to elevate her livestreams. The post OBS Studio to Release Software Update 28.0 With NVIDIA Broadcast Features ‘In the NVIDIA Studio’ appeared first on NVIDIA Blog.  ( 7 min )

Data is the fuel that makes artificial intelligence run. Training machine learning and AI systems requires data. And the quality of datasets has a big impact on the systems’ results. But compiling quality real-world data for AI and ML can be difficult and expensive. That’s where synthetic data comes in. The guest for this week’s Read article > The post Rendered.ai Founder and CEO Nathan Kundtz on Using AI to Build Better AI appeared first on NVIDIA Blog.  ( 5 min )

To track the target in a video, current visual trackers usually adopt greedy search for target object localization in each frame, that is, the candidate region with the maximum response score will be selected as the tracking result of each frame. However, we found that this may be not an optimal choice, especially when encountering challenging tracking scenarios such as heavy occlusion and fast motion. To address this issue, we propose to maintain multiple tracking trajectories and apply beam search strategy for visual tracking, so that the trajectory with fewer accumulated errors can be identified. Accordingly, this paper introduces a novel multi-agent reinforcement learning based beam search tracking strategy, termed BeamTracking. It is mainly inspired by the image captioning task, which takes an image as input and generates diverse descriptions using beam search algorithm. Accordingly, we formulate the tracking as a sample selection problem fulfilled by multiple parallel decision-making processes, each of which aims at picking out one sample as their tracking result in each frame. Each maintained trajectory is associated with an agent to perform the decision-making and determine what actions should be taken to update related information. When all the frames are processed, we select the trajectory with the maximum accumulated score as the tracking result. Extensive experiments on seven popular tracking benchmark datasets validated the effectiveness of the proposed algorithm.

As machine learning (ML) models are increasingly being deployed in high-stakes applications, policymakers have suggested tighter data protection regulations (e.g., GDPR, CCPA). One key principle is the ``right to be forgotten'' which gives users the right to have their data deleted. Another key principle is the right to an actionable explanation, also known as algorithmic recourse, allowing users to reverse unfavorable decisions. To date it is unknown whether these two principles can be operationalized simultaneously. Therefore, we introduce and study the problem of recourse invalidation in the context of data deletion requests. More specifically, we theoretically and empirically analyze the behavior of popular state-of-the-art algorithms and demonstrate that the recourses generated by these algorithms are likely to be invalidated if a small number of data deletion requests (e.g., 1 or 2) warrant updates of the predictive model. For the setting of linear models and overparameterized neural networks -- studied through the lens of neural tangent kernels (NTKs) -- we suggest a framework to identify a minimal subset of critical training points, which when removed, would lead to maximize the fraction of invalidated recourses. Using our framework, we empirically establish that the removal of as little as 2 data instances from the training set can invalidate up to 95 percent of all recourses output by popular state-of-the-art algorithms. Thus, our work raises fundamental questions about the compatibility of ``the right to an actionable explanation'' in the context of the ``right to be forgotten''.

Implementing deep neural networks for learning the solution maps of parametric partial differential equations (PDEs) turns out to be more efficient than using many conventional numerical methods. However, limited theoretical analyses have been conducted on this approach. In this study, we investigate the expressive power of deep rectified quadratic unit (ReQU) neural networks for approximating the solution maps of parametric PDEs. The proposed approach is motivated by the recent important work of G. Kutyniok, P. Petersen, M. Raslan and R. Schneider (Gitta Kutyniok, Philipp Petersen, Mones Raslan, and Reinhold Schneider. A theoretical analysis of deep neural networks and parametric pdes. Constructive Approximation, pages 1-53, 2021), which uses deep rectified linear unit (ReLU) neural networks for solving parametric PDEs. In contrast to the previously established complexity-bound $\mathcal{O}\left(d^3\log_{2}^{q}(1/ \epsilon) \right)$ for ReLU neural networks, we derive an upper bound $\mathcal{O}\left(d^3\log_{2}^{q}\log_{2}(1/ \epsilon) \right)$ on the size of the deep ReQU neural network required to achieve accuracy $\epsilon>0$, where $d$ is the dimension of reduced basis representing the solutions. Our method takes full advantage of the inherent low-dimensionality of the solution manifolds and better approximation performance of deep ReQU neural networks. Numerical experiments are performed to verify our theoretical result.

Standardized datasets and benchmarks have spurred innovations in computer vision, natural language processing, multi-modal and tabular settings. We note that, as compared to other well researched fields fraud detection has numerous differences. The differences include a high class imbalance, diverse feature types, frequently changing fraud patterns, and adversarial nature of the problem. Due to these differences, the modeling approaches that are designed for other classification tasks may not work well for the fraud detection. We introduce Fraud Dataset Benchmark (FDB), a compilation of publicly available datasets catered to fraud detection. FDB comprises variety of fraud related tasks, ranging from identifying fraudulent card-not-present transactions, detecting bot attacks, classifying malicious URLs, predicting risk of loan to content moderation. The Python based library from FDB provides consistent API for data loading with standardized training and testing splits. For reference, we also provide baseline evaluations of different modeling approaches on FDB. Considering the increasing popularity of Automated Machine Learning (AutoML) for various research and business problems, we used AutoML frameworks for our baseline evaluations. For fraud prevention, the organizations that operate with limited resources and lack ML expertise often hire a team of investigators, use blocklists and manual rules, all of which are inefficient and do not scale well. Such organizations can benefit from AutoML solutions that are easy to deploy in production and pass the bar of fraud prevention requirements. We hope that FDB helps in the development of customized fraud detection techniques catered to different fraud modus operandi (MOs) as well as in the improvement of AutoML systems that can work well for all datasets in the benchmark.

This paper is concerned with ranking many pre-trained deep neural networks (DNNs), called checkpoints, for the transfer learning to a downstream task. Thanks to the broad use of DNNs, we may easily collect hundreds of checkpoints from various sources. Which of them transfers the best to our downstream task of interest? Striving to answer this question thoroughly, we establish a neural checkpoint ranking benchmark (NeuCRaB) and study some intuitive ranking measures. These measures are generic, applying to the checkpoints of different output types without knowing how the checkpoints are pre-trained on which dataset. They also incur low computation cost, making them practically meaningful. Our results suggest that the linear separability of the features extracted by the checkpoints is a strong indicator of transferability. We also arrive at a new ranking measure, NLEEP, which gives rise to the best performance in the experiments.

While (message-passing) graph neural networks have clear limitations in approximating permutation-equivariant functions over graphs or general relational data, more expressive, higher-order graph neural networks do not scale to large graphs. They either operate on $k$-order tensors or consider all $k$-node subgraphs, implying an exponential dependence on $k$ in memory requirements, and do not adapt to the sparsity of the graph. By introducing new heuristics for the graph isomorphism problem, we devise a class of universal, permutation-equivariant graph networks, which, unlike previous architectures, offer a fine-grained control between expressivity and scalability and adapt to the sparsity of the graph. These architectures lead to vastly reduced computation times compared to standard higher-order graph networks in the supervised node- and graph-level classification and regression regime while significantly improving over standard graph neural network and graph kernel architectures in terms of predictive performance.

Detecting test data deviating from training data is a central problem for safe and robust machine learning. Likelihoods learned by a generative model, e.g., a normalizing flow via standard log-likelihood training, perform poorly as an anomaly score. We propose to use an unlabelled auxiliary dataset and a probabilistic outlier score for anomaly detection. We use a self-supervised feature extractor trained on the auxiliary dataset and train a normalizing flow on the extracted features by maximizing the likelihood on in-distribution data and minimizing the likelihood on the auxiliary dataset. We show that this is equivalent to learning the normalized positive difference between the in-distribution and the auxiliary feature density. We conduct experiments on benchmark datasets and show a robust improvement compared to likelihood, likelihood ratio methods and state-of-the-art anomaly detection methods.

Anomalies in time-series provide insights of critical scenarios across a range of industries, from banking and aerospace to information technology, security, and medicine. However, identifying anomalies in time-series data is particularly challenging due to the imprecise definition of anomalies, the frequent absence of labels, and the enormously complex temporal correlations present in such data. The LSTM Autoencoder is an Encoder-Decoder scheme for Anomaly Detection based on Long Short Term Memory Networks that learns to reconstruct time-series behavior and then uses reconstruction error to identify abnormalities. We introduce the Denoising Architecture as a complement to this LSTM Encoder-Decoder model and investigate its effect on real-world as well as artificially generated datasets. We demonstrate that the proposed architecture increases both the accuracy and the training speed, thereby, making the LSTM Autoencoder more efficient for unsupervised anomaly detection tasks.

Missing data is a commonly occurring problem in practice. Many imputation methods have been developed to fill in the missing entries. However, not all of them can scale to high-dimensional data, especially the multiple imputation techniques. Meanwhile, the data nowadays tends toward high-dimensional. Therefore, in this work, we propose Principal Component Analysis Imputation (PCAI), a simple but versatile framework based on Principal Component Analysis (PCA) to speed up the imputation process and alleviate memory issues of many available imputation techniques, without sacrificing the imputation quality in term of MSE. In addition, the frameworks can be used even when some or all of the missing features are categorical, or when the number of missing features is large. Next, we introduce PCA Imputation - Classification (PIC), an application of PCAI for classification problems with some adjustments. We validate our approach by experiments on various scenarios, which shows that PCAI and PIC can work with various imputation algorithms, including the state-of-the-art ones and improve the imputation speed significantly, while achieving competitive mean square error/classification accuracy compared to direct imputation (i.e., impute directly on the missing data).

Adversarial machine learning is an emerging area showing the vulnerability of deep learning models. Exploring attack methods to challenge state of the art artificial intelligence (A.I.) models is an area of critical concern. The reliability and robustness of such A.I. models are one of the major concerns with an increasing number of effective adversarial attack methods. Classification tasks are a major vulnerable area for adversarial attacks. The majority of attack strategies are developed for colored or gray-scaled images. Consequently, adversarial attacks on binary image recognition systems have not been sufficiently studied. Binary images are simple two possible pixel-valued signals with a single channel. The simplicity of binary images has a significant advantage compared to colored and gray scaled images, namely computation efficiency. Moreover, most optical character recognition systems (O.C.R.s), such as handwritten character recognition, plate number identification, and bank check recognition systems, use binary images or binarization in their processing steps. In this paper, we propose a simple yet efficient attack method, Efficient Combinatorial Black-box Adversarial Attack, on binary image classifiers. We validate the efficiency of the attack technique on two different data sets and three classification networks, demonstrating its performance. Furthermore, we compare our proposed method with state-of-the-art methods regarding advantages and disadvantages as well as applicability.

Moment methods are an important means of density estimation, but they are generally strongly dependent on the choice of feasible functions, which severely affects the performance. We propose a non-classical parameterization for density estimation using the sample moments, which does not require the choice of such functions. The parameterization is induced by the Kullback-Leibler distance, and the solution of it, which is proved to exist and be unique subject to simple prior that does not depend on data, can be obtained by convex optimization. Simulation results show the performance of the proposed estimator in estimating multi-modal densities which are mixtures of different types of functions.

Elucidating and accurately predicting the druggability and bioactivities of molecules plays a pivotal role in drug design and discovery and remains an open challenge. Recently, graph neural networks (GNN) have made remarkable advancements in graph-based molecular property prediction. However, current graph-based deep learning methods neglect the hierarchical information of molecules and the relationships between feature channels. In this study, we propose a well-designed hierarchical informative graph neural networks framework (termed HiGNN) for predicting molecular property by utilizing a co-representation learning of molecular graphs and chemically synthesizable BRICS fragments. Furthermore, a plug-and-play feature-wise attention block is first designed in HiGNN architecture to adaptively recalibrate atomic features after the message passing phase. Extensive experiments demonstrate that HiGNN achieves state-of-the-art predictive performance on many challenging drug discovery-associated benchmark datasets. In addition, we devise a molecule-fragment similarity mechanism to comprehensively investigate the interpretability of HiGNN model at the subgraph level, indicating that HiGNN as a powerful deep learning tool can help chemists and pharmacists identify the key components of molecules for designing better molecules with desired properties or functions. The source code is publicly available at https://github.com/idruglab/hignn.

Ensembles of Deep Neural Networks (DNNs) have achieved qualitative predictions but they are computing and memory intensive. Therefore, the demand is growing to make them answer a heavy workload of requests with available computational resources. Unlike recent initiatives on inference servers and inference frameworks, which focus on the prediction of single DNNs, we propose a new software layer to serve with flexibility and efficiency ensembles of DNNs. Our inference system is designed with several technical innovations. First, we propose a novel procedure to find a good allocation matrix between devices (CPUs or GPUs) and DNN instances. It runs successively a worst-fit to allocate DNNs into the memory devices and a greedy algorithm to optimize allocation settings and speed up the ensemble. Second, we design the inference system based on multiple processes to run asynchronously: batching, prediction, and the combination rule with an efficient internal communication scheme to avoid overhead. Experiments show the flexibility and efficiency under extreme scenarios: It successes to serve an ensemble of 12 heavy DNNs into 4 GPUs and at the opposite, one single DNN multi-threaded into 16 GPUs. It also outperforms the simple baseline consisting of optimizing the batch size of DNNs by a speedup up to 2.7X on the image classification task.

Staining reveals the micro structure of the aspirate while creating histopathology slides. Stain variation, defined as a chromatic difference between the source and the target, is caused by varying characteristics during staining, resulting in a distribution shift and poor performance on the target. The goal of stain normalization is to match the target's chromatic distribution to that of the source. However, stain normalisation causes the underlying morphology to distort, resulting in an incorrect diagnosis. We propose FUSION, a new method for promoting stain-adaption by adjusting the model to the target in an unsupervised test-time scenario, eliminating the necessity for significant labelling at the target end. FUSION works by altering the target's batch normalization statistics and fusing them with source statistics using a weighting factor. The algorithm reduces to one of two extremes based on the weighting factor. Despite the lack of training or supervision, FUSION surpasses existing equivalent algorithms for classification and dense predictions (segmentation), as demonstrated by comprehensive experiments on two public datasets.

A major challenge in multi-agent systems is that the system complexity grows dramatically with the number of agents as well as the size of their action spaces, which is typical in real world scenarios such as autonomous vehicles, robotic teams, network routing, etc. It is hence in imminent need to design decentralized or independent algorithms where the update of each agent is only based on their local observations without the need of introducing complex communication/coordination mechanisms. In this work, we study the finite-time convergence of independent entropy-regularized natural policy gradient (NPG) methods for potential games, where the difference in an agent's utility function due to unilateral deviation matches exactly that of a common potential function. The proposed entropy-regularized NPG method enables each agent to deploy symmetric, decentralized, and multiplicative updates according to its own payoff. We show that the proposed method converges to the quantal response equilibrium (QRE) -- the equilibrium to the entropy-regularized game -- at a sublinear rate, which is independent of the size of the action space and grows at most sublinearly with the number of agents. Appealingly, the convergence rate further becomes independent with the number of agents for the important special case of identical-interest games, leading to the first method that converges at a dimension-free rate. Our approach can be used as a smoothing technique to find an approximate Nash equilibrium (NE) of the unregularized problem without assuming that stationary policies are isolated.

Efficient exploration is a crucial challenge in deep reinforcement learning. Several methods, such as behavioral priors, are able to leverage offline data in order to efficiently accelerate reinforcement learning on complex tasks. However, if the task at hand deviates excessively from the demonstrated task, the effectiveness of such methods is limited. In our work, we propose to learn features from offline data that are shared by a more diverse range of tasks, such as correlation between actions and directedness. Therefore, we introduce state-free priors, which directly model temporal consistency in demonstrated trajectories, and are capable of driving exploration in complex tasks, even when trained on data collected on simpler tasks. Furthermore, we introduce a novel integration scheme for action priors in off-policy reinforcement learning by dynamically sampling actions from a probabilistic mixture of policy and action prior. We compare our approach against strong baselines and provide empirical evidence that it can accelerate reinforcement learning in long-horizon continuous control tasks under sparse reward settings.

Active regression considers a linear regression problem where the learner receives a large number of data points but can only observe a small number of labels. Since online algorithms can deal with incremental training data and take advantage of low computational cost, we consider an online extension of the active regression problem: the learner receives data points one by one and immediately decides whether it should collect the corresponding labels. The goal is to efficiently maintain the regression of received data points with a small budget of label queries. We propose novel algorithms for this problem under $\ell_p$ loss where $p\in[1,2]$. To achieve a $(1+\epsilon)$-approximate solution, our proposed algorithms only require $\tilde{\mathcal{O}}(\epsilon^{-1} d \log(n\kappa))$ queries of labels, where $n$ is the number of data points and $\kappa$ is a quantity, called the condition number, of the data points. The numerical results verify our theoretical results and show that our methods have comparable performance with offline active regression algorithms.

Adversarial training instances can severely distort a model's behavior. This work investigates certified regression defenses, which provide guaranteed limits on how much a regressor's prediction may change under a training-set attack. Our key insight is that certified regression reduces to certified classification when using median as a model's primary decision function. Coupling our reduction with existing certified classifiers, we propose six new provably-robust regressors. To the extent of our knowledge, this is the first work that certifies the robustness of individual regression predictions without any assumptions about the data distribution and model architecture. We also show that existing state-of-the-art certified classifiers often make overly-pessimistic assumptions that can degrade their provable guarantees. We introduce a tighter analysis of model robustness, which in many cases results in significantly improved certified guarantees. Lastly, we empirically demonstrate our approaches' effectiveness on both regression and classification data, where the accuracy of up to 50% of test predictions can be guaranteed under 1% training-set corruption and up to 30% of predictions under 4% corruption. Our source code is available at https://github.com/ZaydH/certified-regression.

Transfer learning improves the performance of the target task by leveraging the data of a specific source task: the closer the relationship between the source and the target tasks, the greater the performance improvement by transfer learning. In neuroscience, the relationship between cognitive tasks is usually represented by similarity of activated brain regions or neural representation. However, no study has linked transfer learning and neuroscience to reveal the relationship between cognitive tasks. In this study, we propose a transfer learning framework to reflect the relationship between cognitive tasks, and compare the task relations reflected by transfer learning and by the overlaps of brain regions (e.g., neurosynth). Our results of transfer learning create cognitive taskonomy to reflect the relationship between cognitive tasks which is well in line with the task relations derived from neurosynth. Transfer learning performs better in task decoding with fMRI data if the source and target cognitive tasks activate similar brain regions. Our study uncovers the relationship of multiple cognitive tasks and provides guidance for source task selection in transfer learning for neural decoding based on small-sample data.

Obesity is a serious issue in the modern society since it associates to a significantly reduced quality of life. Current research conducted to explore the obesity-related neurological evidences using electroencephalography (EEG) data are limited to traditional approaches. In this study, we developed a novel machine learning model to identify brain networks of obese females using alpha band functional connectivity features derived from EEG data. An overall classification accuracy of 90% is achieved. Our finding suggests that the obese brain is characterized by a dysfunctional network in which the areas that are responsible for processing self-referential information such as energy requirement are impaired.

Continual Learning (CL, sometimes also termed incremental learning) is a flavor of machine learning where the usual assumption of stationary data distribution is relaxed or omitted. When naively applying, e.g., DNNs in CL problems, changes in the data distribution can cause the so-called catastrophic forgetting (CF) effect: an abrupt loss of previous knowledge. Although many significant contributions to enabling CL have been made in recent years, most works address supervised (classification) problems. This article reviews literature that study CL in other settings, such as learning with reduced supervision, fully unsupervised learning, and reinforcement learning. Besides proposing a simple schema for classifying CL approaches w.r.t. their level of autonomy and supervision, we discuss the specific challenges associated with each setting and the potential contributions to the field of CL in general.

This article studies the estimation of latent community memberships from pairwise interactions in a network of $N$ nodes, where the observed interactions can be of arbitrary type, including binary, categorical, and vector-valued, and not excluding even more general objects such as time series or spatial point patterns. As a generative model for such data, we introduce a stochastic block model with a general measurable interaction space $\mathcal S$, for which we derive information-theoretic bounds for the minimum achievable error rate. These bounds yield sharp criteria for the existence of consistent and strongly consistent estimators in terms of data sparsity, statistical similarity between intra- and inter-block interaction distributions, and the shape and size of the interaction space. The general framework makes it possible to study temporal and multiplex networks with $\mathcal S = \{0,1\}^T$, in settings where both $N \to \infty$ and $T \to \infty$, and the temporal interaction patterns are correlated over time. For temporal Markov interactions, we derive sharp consistency thresholds. We also present fast online estimation algorithms which fully utilise the non-binary nature of the observed data. Numerical experiments on synthetic and real data show that these algorithms rapidly produce accurate estimates even for very sparse data arrays.

Weak supervision (WS) is a powerful method to build labeled datasets for training supervised models in the face of little-to-no labeled data. It replaces hand-labeling data with aggregating multiple noisy-but-cheap label estimates expressed by labeling functions (LFs). While it has been used successfully in many domains, weak supervision's application scope is limited by the difficulty of constructing labeling functions for domains with complex or high-dimensional features. To address this, a handful of methods have proposed automating the LF design process using a small set of ground truth labels. In this work, we introduce AutoWS-Bench-101: a framework for evaluating automated WS (AutoWS) techniques in challenging WS settings -- a set of diverse application domains on which it has been previously difficult or impossible to apply traditional WS techniques. While AutoWS is a promising direction toward expanding the application-scope of WS, the emergence of powerful methods such as zero-shot foundation models reveals the need to understand how AutoWS techniques compare or cooperate with modern zero-shot or few-shot learners. This informs the central question of AutoWS-Bench-101: given an initial set of 100 labels for each task, we ask whether a practitioner should use an AutoWS method to generate additional labels or use some simpler baseline, such as zero-shot predictions from a foundation model or supervised learning. We observe that in many settings, it is necessary for AutoWS methods to incorporate signal from foundation models if they are to outperform simple few-shot baselines, and AutoWS-Bench-101 promotes future research in this direction. We conclude with a thorough ablation study of AutoWS methods.

This paper presents a novel way to apply mathematical finance and machine learning (ML) to forecast stock options prices. Following results from the paper Quasi-Reversibility Method and Neural Network Machine Learning to Solution of Black-Scholes Equations (appeared on the AMS Contemporary Mathematics journal), we create and evaluate new empirical mathematical models for the Black-Scholes equation to analyze data for 92,846 companies. We solve the Black-Scholes (BS) equation forwards in time as an ill-posed inverse problem, using the Quasi-Reversibility Method (QRM), to predict option price for the future one day. For each company, we have 13 elements including stock and option daily prices, volatility, minimizer, etc. Because the market is so complicated that there exists no perfect model, we apply ML to train algorithms to make the best prediction. The current stage of research combines QRM with Convolutional Neural Networks (CNN), which learn information across a large number of data points simultaneously. We implement CNN to generate new results by validating and testing on sample market data. We test different ways of applying CNN and compare our CNN models with previous models to see if achieving a higher profit rate is possible.

For the Hamiltonian system, this work considers the learning and prediction of the position (q) and momentum (p) variables generated by a symplectic evolution map. Similar to Chen & Tao (2021), the symplectic map is represented by the generating function. In addition, we develop a new learning scheme by splitting the time series (q_i, p_i) into several partitions, and then train a leap-frog neural network (LFNN) to approximate the generating function between the first (i.e. initial condition) and one of the rest partitions. For predicting the system evolution in a short timescale, the LFNN could effectively avoid the issue of accumulative error. Then the LFNN is applied to learn the behavior of the 2:3 resonant Kuiper belt objects, in a much longer time period, and there are two significant improvements on the neural network constructed in our previous work (Li et al. 2022): (1) conservation of the Jacobi integral ; (2) highly accurate prediction of the orbital evolution. We propose that the LFNN may be useful to make the prediction of the long time evolution of the Hamiltonian system.

Competition between traditional platforms is known to improve user utility by aligning the platform's actions with user preferences. But to what extent is alignment exhibited in data-driven marketplaces? To study this question from a theoretical perspective, we introduce a duopoly market where platform actions are bandit algorithms and the two platforms compete for user participation. A salient feature of this market is that the quality of recommendations depends on both the bandit algorithm and the amount of data provided by interactions from users. This interdependency between the algorithm performance and the actions of users complicates the structure of market equilibria and their quality in terms of user utility. Our main finding is that competition in this market does not perfectly align market outcomes with user utility. Interestingly, market outcomes exhibit misalignment not only when the platforms have separate data repositories, but also when the platforms have a shared data repository. Nonetheless, the data sharing assumptions impact what mechanism drives misalignment and also affect the specific form of misalignment (e.g. the quality of the best-case and worst-case market outcomes). More broadly, our work illustrates that competition in digital marketplaces has subtle consequences for user utility that merit further investigation.

There is a pressing market demand to minimize the test time of Prompt Gamma Neutron Activation Analysis (PGNAA) spectra measurement machine, so that it could function as an instant material analyzer, e.g. to classify waste samples instantaneously and determine the best recycling method based on the detected compositions of the testing sample. This article introduces a new development of the deep learning classification and contrive to reduce the test time for PGNAA machine. We propose both Random Sampling Methods and Class Activation Map (CAM) to generate "downsized" samples and train the CNN model continuously. Random Sampling Methods (RSM) aims to reduce the measuring time within a sample, and Class Activation Map (CAM) is for filtering out the less important energy range of the downsized samples. We shorten the overall PGNAA measuring time down to 2.5 seconds while ensuring the accuracy is around 96.88 % for our dataset with 12 different species of substances. Compared with classifying different species of materials, it requires more test time (sample count rate) for substances having the same elements to archive good accuracy. For example, the classification of copper alloys requires nearly 24 seconds test time to reach 98 % accuracy.

The binary code similarity detection (BCSD) method measures the similarity of two binary executable codes. Recently, the learning-based BCSD methods have achieved great success, outperforming traditional BCSD in detection accuracy and efficiency. However, the existing studies are rather sparse on the adversarial vulnerability of the learning-based BCSD methods, which cause hazards in security-related applications. To evaluate the adversarial robustness, this paper designs an efficient and black-box adversarial code generation algorithm, namely, FuncFooler. FuncFooler constrains the adversarial codes 1) to keep unchanged the program's control flow graph (CFG), and 2) to preserve the same semantic meaning. Specifically, FuncFooler consecutively 1) determines vulnerable candidates in the malicious code, 2) chooses and inserts the adversarial instructions from the benign code, and 3) corrects the semantic side effect of the adversarial code to meet the constraints. Empirically, our FuncFooler can successfully attack the three learning-based BCSD models, including SAFE, Asm2Vec, and jTrans, which calls into question whether the learning-based BCSD is desirable.

Medical images used in clinical practice are heterogeneous and not the same quality as scans studied in academic research. Preprocessing breaks down in extreme cases when anatomy, artifacts, or imaging parameters are unusual or protocols are different. Methods robust to these variations are most needed. A novel deep learning method is proposed for fast and accurate segmentation of the human brain into 132 regions. The proposed model uses an efficient U-Net-like network and benefits from the intersection points of different views and hierarchical relations for the fusion of the orthogonal 2D planes and brain labels during the end-to-end training. Weakly supervised learning is deployed to take the advantage of partially labeled data for the whole brain segmentation and estimation of the intracranial volume (ICV). Moreover, data augmentation is used to expand the magnetic resonance imaging (MRI) data by generating realistic brain scans with high variability for robust training of the model while preserving data privacy. The proposed method can be applied to brain MRI data including skull or any other artifacts without preprocessing the images or a drop in performance. Several experiments using different atlases are conducted to evaluate the segmentation performance of the trained model compared to the state-of-the-art, and the results show higher segmentation accuracy and robustness of the proposed model compared to the existing methods across different intra- and inter-domain datasets.

Forecasting the behavior of high-dimensional dynamical systems using machine learning requires efficient methods to learn the underlying physical model. We demonstrate spatiotemporal chaos prediction using a machine learning architecture that, when combined with a next-generation reservoir computer, displays state-of-the-art performance with a computational time $10^3-10^4$ times faster for training process and training data set $\sim 10^2$ times smaller than other machine learning algorithms. We also take advantage of the translational symmetry of the model to further reduce the computational cost and training data, each by a factor of $\sim$10.

Recent advancements in technology have led to a boost in social media usage which has ultimately led to large amounts of user-generated data which also includes hateful and offensive speech. The language used in social media is often a combination of English and the native language in the region. In India, Hindi is used predominantly and is often code-switched with English, giving rise to the Hinglish (Hindi+English) language. Various approaches have been made in the past to classify the code-mixed Hinglish hate speech using different machine learning and deep learning-based techniques. However, these techniques make use of recurrence on convolution mechanisms which are computationally expensive and have high memory requirements. Past techniques also make use of complex data processing making the existing techniques very complex and non-sustainable to change in data. We propose a much simpler approach which is not only at par with these complex networks but also exceeds performance with the use of subword tokenization algorithms like BPE and Unigram along with multi-head attention-based technique giving an accuracy of 87.41% and F1 score of 0.851 on standard datasets. Efficient use of BPE and Unigram algorithms help handle the non-conventional Hinglish vocabulary making our technique simple, efficient and sustainable to use in the real world.

Rapid progress in deep learning is leading to a diverse set of quickly changing models, with a dramatically growing demand for compute. However, as frameworks specialize performance optimization to patterns in popular networks, they implicitly constrain novel and diverse models that drive progress in research. We empower deep learning researchers by defining a flexible and user-customizable pipeline for optimizing training of arbitrary deep neural networks, based on data movement minimization. The pipeline begins with standard networks in PyTorch or ONNX and transforms computation through progressive lowering. We define four levels of general-purpose transformations, from local intra-operator optimizations to global data movement reduction. These operate on a data-centric graph intermediate representation that expresses computation and data movement at all levels of abstraction, including expanding basic operators such as convolutions to their underlying computations. Central to the design is the interactive and introspectable nature of the pipeline. Every part is extensible through a Python API, and can be tuned interactively using a GUI. We demonstrate competitive performance or speedups on ten different networks, with interactive optimizations discovering new opportunities in EfficientNet.

The network embedding task is to represent the node in the network as a low-dimensional vector while incorporating the topological and structural information. Most existing approaches solve this problem by factorizing a proximity matrix, either directly or implicitly. In this work, we introduce a network embedding method from a new perspective, which leverages Modern Hopfield Networks (MHN) for associative learning. Our network learns associations between the content of each node and that node's neighbors. These associations serve as memories in the MHN. The recurrent dynamics of the network make it possible to recover the masked node, given that node's neighbors. Our proposed method is evaluated on different downstream tasks such as node classification and linkage prediction. The results show competitive performance compared to the common matrix factorization techniques and deep learning based methods.

The central object of this PhD thesis is known under different names in the fields of computer science and statistical mechanics. In computer science, it is called the Maximum Cut problem, one of the famous twenty-one Karp's original NP-hard problems, while the same object from Physics is called the Ising Spin Glass model. This model of a rich structure often appears as a reduction or reformulation of real-world problems from computer science, physics and engineering. However, solving this model exactly (finding the maximal cut or the ground state) is likely to stay an intractable problem (unless $\textit{P} = \textit{NP}$) and requires the development of ad-hoc heuristics for every particular family of instances. One of the bright and beautiful connections between discrete and continuous optimization is a Semidefinite Programming-based rounding scheme for Maximum Cut. This procedure allows us to find a provably near-optimal solution; moreover, this method is conjectured to be the best possible in polynomial time. In the first two chapters of this thesis, we investigate local non-convex heuristics intended to improve the rounding scheme. In the last chapter of this thesis, we make one step further and aim to control the solution of the problem we wanted to solve in previous chapters. We formulate a bi-level optimization problem over the Ising model where we want to tweak the interactions as little as possible so that the ground state of the resulting Ising model satisfies the desired criteria. This kind of problem arises in pandemic modeling. We show that when the interactions are non-negative, our bi-level optimization is solvable in polynomial time using convex programming.

MapReduce (MR) model algorithms for maximizing monotone, submodular functions subject to a cardinality constraint (SMCC) are currently restricted to the use of the linear-adaptive (non-parallelizable) algorithm GREEDY. Low-adaptive algorithms do not satisfy the requirements of these distributed MR frameworks, thereby limiting their performance. We study the SMCC problem in a distributed setting and propose the first MR algorithms with sublinear adaptive complexity. Our algorithms, R-DASH, T-DASH and G-DASH provide ($0.316-\varepsilon$), ($0.375-\varepsilon$) and ($0.632-\varepsilon$) approximation ratio respectively with near-optimal adaptive complexity. Additionally, we provide a memory-efficient framework MED that eliminates the memory limitations of all MR model algorithms resulting from large distributed setups or considerable cardinality constraints. Finally, we provide empirical evidence to demonstrate that our sublinear-adaptive distributed algorithms provide orders of magnitude faster speedup in runtime compared to current state-of-the-art distributed algorithms while producing near identical results.

While machine learning and ranking-based systems are in widespread use for sensitive decision-making processes (e.g., determining job candidates, assigning credit scores), they are rife with concerns over unintended biases in their outcomes, which makes algorithmic fairness (e.g., demographic parity, equal opportunity) an objective of interest. 'Algorithmic recourse' offers feasible recovery actions to change unwanted outcomes through the modification of attributes. We introduce the notion of ranked group-level recourse fairness, and develop a 'recourse-aware ranking' solution that satisfies ranked recourse fairness constraints while minimizing the cost of suggested modifications. Our solution suggests interventions that can reorder the ranked list of database records and mitigate group-level unfairness; specifically, disproportionate representation of sub-groups and recourse cost imbalance. This re-ranking identifies the minimum modifications to data points, with these attribute modifications weighted according to their ease of recourse. We then present an efficient block-based extension that enables re-ranking at any granularity (e.g., multiple brackets of bank loan interest rates, multiple pages of search engine results). Evaluation on real datasets shows that, while existing methods may even exacerbate recourse unfairness, our solution -- RAGUEL -- significantly improves recourse-aware fairness. RAGUEL outperforms alternatives at improving recourse fairness, through a combined process of counterfactual generation and re-ranking, whilst remaining efficient for large-scale datasets.

We aim to resolve this problem by introducing a comprehensive distributed deep learning (DDL) profiler, which can determine the various execution "stalls" that DDL suffers from while running on a public cloud. We have implemented the profiler by extending prior work to additionally estimate two types of communication stalls - interconnect and network stalls. We train popular DNN models using the profiler to characterize various AWS GPU instances and list their advantages and shortcomings for users to make an informed decision. We observe that the more expensive GPU instances may not be the most performant for all DNN models and AWS may sub-optimally allocate hardware interconnect resources. Specifically, the intra-machine interconnect can introduce communication overheads up to 90% of DNN training time and network-connected instances can suffer from up to 5x slowdown compared to training on a single instance. Further, we model the impact of DNN macroscopic features such as the number of layers and the number of gradients on communication stalls. Finally, we propose a measurement-based recommendation model for users to lower their public cloud monetary costs for DDL, given a time budget.

Camera traps have revolutionized the animal research of many species that were previously nearly impossible to observe due to their habitat or behavior. They are cameras generally fixed to a tree that take a short sequence of images when triggered. Deep learning has the potential to overcome the workload to automate image classification according to taxon or empty images. However, a standard deep neural network classifier fails because animals often represent a small portion of the high-definition images. That is why we propose a workflow named Weakly Object Detection Faster-RCNN+FPN which suits this challenge. The model is weakly supervised because it requires only the animal taxon label per image but doesn't require any manual bounding box annotations. First, it automatically performs the weakly-supervised bounding box annotation using the motion from multiple frames. Then, it trains a Faster-RCNN+FPN model using this weak supervision. Experimental results have been obtained with two datasets from a Papua New Guinea and Missouri biodiversity monitoring campaign, then on an easily reproducible testbed.

Normalization methods such as batch [Ioffe and Szegedy, 2015], weight [Salimansand Kingma, 2016], instance [Ulyanov et al., 2016], and layer normalization [Baet al., 2016] have been widely used in modern machine learning. Here, we study the weight normalization (WN) method [Salimans and Kingma, 2016] and a variant called reparametrized projected gradient descent (rPGD) for overparametrized least-squares regression. WN and rPGD reparametrize the weights with a scale g and a unit vector w and thus the objective function becomes non-convex. We show that this non-convex formulation has beneficial regularization effects compared to gradient descent on the original objective. These methods adaptively regularize the weights and converge close to the minimum l2 norm solution, even for initializations far from zero. For certain stepsizes of g and w , we show that they can converge close to the minimum norm solution. This is different from the behavior of gradient descent, which converges to the minimum norm solution only when started at a point in the range space of the feature matrix, and is thus more sensitive to initialization.

Reinforcement learning (RL) is a machine learning paradigm where an autonomous agent learns to make an optimal sequence of decisions by interacting with the underlying environment. The promise demonstrated by RL-guided workflows in unraveling electronic design automation problems has encouraged hardware security researchers to utilize autonomous RL agents in solving domain-specific problems. From the perspective of hardware security, such autonomous agents are appealing as they can generate optimal actions in an unknown adversarial environment. On the other hand, the continued globalization of the integrated circuit supply chain has forced chip fabrication to off-shore, untrustworthy entities, leading to increased concerns about the security of the hardware. Furthermore, the unknown adversarial environment and increasing design complexity make it challenging for defenders to detect subtle modifications made by attackers (a.k.a. hardware Trojans). In this brief, we outline the development of RL agents in detecting hardware Trojans, one of the most challenging hardware security problems. Additionally, we outline potential opportunities and enlist the challenges of applying RL to solve hardware security problems.

Human usually composes music by organizing elements according to the musical form to express music ideas. However, for neural network-based music generation, it is difficult to do so due to the lack of labelled data on musical form. In this paper, we develop MeloForm, a system that generates melody with musical form using expert systems and neural networks. Specifically, 1) we design an expert system to generate a melody by developing musical elements from motifs to phrases then to sections with repetitions and variations according to pre-given musical form; 2) considering the generated melody is lack of musical richness, we design a Transformer based refinement model to improve the melody without changing its musical form. MeloForm enjoys the advantages of precise musical form control by expert systems and musical richness learning via neural models. Both subjective and objective experimental evaluations demonstrate that MeloForm generates melodies with precise musical form control with 97.79% accuracy, and outperforms baseline systems in terms of subjective evaluation score by 0.75, 0.50, 0.86 and 0.89 in structure, thematic, richness and overall quality, without any labelled musical form data. Besides, MeloForm can support various kinds of forms, such as verse and chorus form, rondo form, variational form, sonata form, etc.

Adversarial examples are inputs for machine learning models that have been designed by attackers to cause the model to make mistakes. In this paper, we demonstrate that adversarial examples can also be utilized for good to improve the performance of imbalanced learning. We provide a new perspective on how to deal with imbalanced data: adjust the biased decision boundary by training with Guiding Adversarial Examples (GAEs). Our method can effectively increase the accuracy of minority classes while sacrificing little accuracy on majority classes. We empirically show, on several benchmark datasets, our proposed method is comparable to the state-of-the-art method. To our best knowledge, we are the first to deal with imbalanced learning with adversarial examples.

Inverse design, the process of matching a device or process parameters to exhibit a desired performance, is applied in many disciplines ranging from material design over chemical processes and to engineering. Machine learning has emerged as a promising approach to overcome current limitations imposed by the dimensionality of the parameter space and multimodal parameter distributions. Most traditional optimization routines assume an invertible one-to-one mapping between the design parameters and the target performance. However, comparable or even identical performance may be realized by different designs, yielding a multimodal distribution of possible solutions to the inverse design problem which confuses the optimization algorithm. Here, we show how a generative modeling approach based on invertible neural networks can provide the full distribution of possible solutions to the inverse design problem and resolve the ambiguity of nanodevice inverse design problems featuring multimodal distributions. We implement a Conditional Invertible Neural Network (cINN) and apply it to a proof-of-principle nanophotonic problem, consisting in tailoring the transmission spectrum of a metallic film milled by subwavelength indentations. We compare our approach with the commonly used conditional Variational Autoencoder (cVAE) framework and show the superior flexibility and accuracy of the proposed cINNs when dealing with multimodal device distributions. Our work shows that invertible neural networks provide a valuable and versatile toolkit for advancing inverse design in nanoscience and nanotechnology.

This work proposes a clusterization algorithm called k-Morphological Sets (k-MS), based on morphological reconstruction and heuristics. k-MS is faster than the CPU-parallel k-Means in worst case scenarios and produces enhanced visualizations of the dataset as well as very distinct clusterizations. It is also faster than similar clusterization methods that are sensitive to density and shapes such as Mitosis and TRICLUST. In addition, k-MS is deterministic and has an intrinsic sense of maximal clusters that can be created for a given input sample and input parameters, differing from k-Means and other clusterization algorithms. In other words, given a constant k, a structuring element and a dataset, k-MS produces k or less clusters without using random/ pseudo-random functions. Finally, the proposed algorithm also provides a straightforward means for removing noise from images or datasets in general.

When an agent encounters a continual stream of new tasks in the lifelong learning setting, it leverages the knowledge it gained from the earlier tasks to help learn the new tasks better. In such a scenario, identifying an efficient knowledge representation becomes a challenging problem. Most research works propose to either store a subset of examples from the past tasks in a replay buffer, dedicate a separate set of parameters to each task or penalize excessive updates over parameters by introducing a regularization term. While existing methods employ the general task-agnostic stochastic gradient descent update rule, we propose a task-aware optimizer that adapts the learning rate based on the relatedness among tasks. We utilize the directions taken by the parameters during the updates by accumulating the gradients specific to each task. These task-based accumulated gradients act as a knowledge base that is maintained and updated throughout the stream. We empirically show that our proposed adaptive learning rate not only accounts for catastrophic forgetting but also allows positive backward transfer. We also show that our method performs better than several state-of-the-art methods in lifelong learning on complex datasets with a large number of tasks.

As an emerging technology in the era of Industry 4.0, digital twin is gaining unprecedented attention because of its promise to further optimize process design, quality control, health monitoring, decision and policy making, and more, by comprehensively modeling the physical world as a group of interconnected digital models. In a two-part series of papers, we examine the fundamental role of different modeling techniques, twinning enabling technologies, and uncertainty quantification and optimization methods commonly used in digital twins. This first paper presents a thorough literature review of digital twin trends across many disciplines currently pursuing this area of research. Then, digital twin modeling and twinning enabling technologies are further analyzed by classifying them into two main categories: physical-to-virtual, and virtual-to-physical, based on the direction in which data flows. Finally, this paper provides perspectives on the trajectory of digital twin technology over the next decade, and introduces a few emerging areas of research which will likely be of great use in future digital twin research. In part two of this review, the role of uncertainty quantification and optimization are discussed, a battery digital twin is demonstrated, and more perspectives on the future of digital twin are shared.

Structural health monitoring (SHM) has been an active research area for the last three decades, and has accumulated a number of critical advances over that period, as can be seen in the literature. However, SHM is still facing challenges because of the paucity of damage-state data, operational and environmental fluctuations, repeatability issues, and changes in boundary conditions. These issues present as inconsistencies in the captured features and can have a huge impact on the practical implementation, but more critically, on the generalisation of the technology. Population-based SHM has been designed to address some of these concerns by modelling and transferring missing information using data collected from groups of similar structures. In this work, vibration data were collected from four healthy, nominally-identical, full-scale composite helicopter blades. Manufacturing differences (e.g., slight differences in geometry and/or material properties), among the blades presented as variability in their structural dynamics, which can be very problematic for SHM based on machine learning from vibration data. This work aims to address this variability by defining a general model for the frequency response functions of the blades, called a form, using mixtures of Gaussian processes.

Many U.S. metropolitan cities are notorious for their severe shortage of parking spots. To this end, we present a proactive prediction-driven optimization framework to dynamically adjust parking prices. We use state-of-the-art deep learning technologies such as neural ordinary differential equations (NODEs) to design our future parking occupancy rate prediction model given historical occupancy rates and price information. Owing to the continuous and bijective characteristics of NODEs, in addition, we design a one-shot price optimization method given a pre-trained prediction model, which requires only one iteration to find the optimal solution. In other words, we optimize the price input to the pre-trained prediction model to achieve targeted occupancy rates in the parking blocks. We conduct experiments with the data collected in San Francisco and Seattle for years. Our prediction model shows the best accuracy in comparison with various temporal or spatio-temporal forecasting models. Our one-shot optimization method greatly outperforms other black-box and white-box search methods in terms of the search time and always returns the optimal price solution.

This paper proposes a neural architecture search (NAS) method for split computing. Split computing is an emerging machine-learning inference technique that addresses the privacy and latency challenges of deploying deep learning in IoT systems. In split computing, neural network models are separated and cooperatively processed using edge servers and IoT devices via networks. Thus, the architecture of the neural network model significantly impacts the communication payload size, model accuracy, and computational load. In this paper, we address the challenge of optimizing neural network architecture for split computing. To this end, we proposed NASC, which jointly explores optimal model architecture and a split point to achieve higher accuracy while meeting latency requirements (i.e., smaller total latency of computation and communication than a certain threshold). NASC employs a one-shot NAS that does not require repeating model training for a computationally efficient architecture search. Our performance evaluation using hardware (HW)-NAS-Bench of benchmark data demonstrates that the proposed NASC can improve the ``communication latency and model accuracy" trade-off, i.e., reduce the latency by approximately 40-60% from the baseline, with slight accuracy degradation.

Learning-based visual ego-motion estimation is promising yet not ready for navigating agile mobile robots in the real world. In this article, we propose CUAHN-VIO, a robust and efficient monocular visual-inertial odometry (VIO) designed for micro aerial vehicles (MAVs) equipped with a downward-facing camera. The vision frontend is a content-and-uncertainty-aware homography network (CUAHN) that is robust to non-homography image content and failure cases of network prediction. It not only predicts the homography transformation but also estimates its uncertainty. The training is self-supervised, so that it does not require ground truth that is often difficult to obtain. The network has good generalization that enables "plug-and-play" deployment in new environments without fine-tuning. A lightweight extended Kalman filter (EKF) serves as the VIO backend and utilizes the mean prediction and variance estimation from the network for visual measurement updates. CUAHN-VIO is evaluated on a high-speed public dataset and shows rivaling accuracy to state-of-the-art (SOTA) VIO approaches. Thanks to the robustness to motion blur, low network inference time (~23ms), and stable processing latency (~26ms), CUAHN-VIO successfully runs onboard an Nvidia Jetson TX2 embedded processor to navigate a fast autonomous MAV.

While previous speech-driven talking face generation methods have made significant progress in improving the visual quality and lip-sync quality of the synthesized videos, they pay less attention to lip motion jitters which greatly undermine the realness of talking face videos. What causes motion jitters, and how to mitigate the problem? In this paper, we conduct systematic analyses on the motion jittering problem based on a state-of-the-art pipeline that uses 3D face representations to bridge the input audio and output video, and improve the motion stability with a series of effective designs. We find that several issues can lead to jitters in synthesized talking face video: 1) jitters from the input 3D face representations; 2) training-inference mismatch; 3) lack of dependency modeling among video frames. Accordingly, we propose three effective solutions to address this issue: 1) we propose a gaussian-based adaptive smoothing module to smooth the 3D face representations to eliminate jitters in the input; 2) we add augmented erosions on the input data of the neural renderer in training to simulate the distortion in inference to reduce mismatch; 3) we develop an audio-fused transformer generator to model dependency among video frames. Besides, considering there is no off-the-shelf metric for measuring motion jitters in talking face video, we devise an objective metric (Motion Stability Index, MSI), to quantitatively measure the motion jitters by calculating the reciprocal of variance acceleration. Extensive experimental results show the superiority of our method on motion-stable face video generation, with better quality than previous systems.

Multi-user delay constrained scheduling is important in many real-world applications including wireless communication, live streaming, and cloud computing. Yet, it poses a critical challenge since the scheduler needs to make real-time decisions to guarantee the delay and resource constraints simultaneously without prior information of system dynamics, which can be time-varying and hard to estimate. Moreover, many practical scenarios suffer from partial observability issues, e.g., due to sensing noise or hidden correlation. To tackle these challenges, we propose a deep reinforcement learning (DRL) algorithm, named Recurrent Softmax Delayed Deep Double Deterministic Policy Gradient ($\mathtt{RSD4}$), which is a data-driven method based on a Partially Observed Markov Decision Process (POMDP) formulation. $\mathtt{RSD4}$ guarantees resource and delay constraints by Lagrangian dual and delay-sensitive queues, respectively. It also efficiently tackles partial observability with a memory mechanism enabled by the recurrent neural network (RNN) and introduces user-level decomposition and node-level merging to ensure scalability. Extensive experiments on simulated/real-world datasets demonstrate that $\mathtt{RSD4}$ is robust to system dynamics and partially observable environments, and achieves superior performances over existing DRL and non-DRL-based methods.

Knowledge graphs (KGs) have gained prominence for their ability to learn representations for uni-relational facts. Recently, research has focused on modeling hyper-relational facts, which move beyond the restriction of uni-relational facts and allow us to represent more complex and real-world information. However, existing approaches for learning representations on hyper-relational KGs majorly focus on enhancing the communication from qualifiers to base triples while overlooking the flow of information from base triple to qualifiers. This can lead to suboptimal qualifier representations, especially when a large amount of qualifiers are presented. It motivates us to design a framework that utilizes multiple aggregators to learn representations for hyper-relational facts: one from the perspective of the base triple and the other one from the perspective of the qualifiers. Experiments demonstrate the effectiveness of our framework for hyper-relational knowledge graph completion across multiple datasets. Furthermore, we conduct an ablation study that validates the importance of the various components in our framework. The code to reproduce our results can be found at \url{https://github.com/HarryShomer/QUAD}.

Training deep neural networks (DNNs) is an important and challenging optimization problem in machine learning due to its non-convexity and non-separable structure. The alternating minimization (AM) approaches split the composition structure of DNNs and have drawn great interest in the deep learning and optimization communities. In this paper, we propose a unified framework for analyzing the convergence rate of AM-type network training methods. Our analysis are based on the $j$-step sufficient decrease conditions and the Kurdyka-Lojasiewicz (KL) property, which relaxes the requirement of designing descent algorithms. We show the detailed local convergence rate if the KL exponent $\theta$ varies in $[0,1)$. Moreover, the local R-linear convergence is discussed under a stronger $j$-step sufficient decrease condition.

In industrial applications, nearly half the failures of motors are caused by the degradation of rolling element bearings (REBs). Therefore, accurately estimating the remaining useful life (RUL) for REBs are of crucial importance to ensure the reliability and safety of mechanical systems. To tackle this challenge, model-based approaches are often limited by the complexity of mathematical modeling. Conventional data-driven approaches, on the other hand, require massive efforts to extract the degradation features and construct health index. In this paper, a novel online data-driven framework is proposed to exploit the adoption of deep convolutional neural networks (CNN) in predicting the RUL of bearings. More concretely, the raw vibrations of training bearings are first processed using the Hilbert-Huang transform (HHT) and a novel nonlinear degradation indicator is constructed as the label for learning. The CNN is then employed to identify the hidden pattern between the extracted degradation indicator and the vibration of training bearings, which makes it possible to estimate the degradation of the test bearings automatically. Finally, testing bearings' RULs are predicted by using a $\epsilon$-support vector regression model. The superior performance of the proposed RUL estimation framework, compared with the state-of-the-art approaches, is demonstrated through the experimental results. The generality of the proposed CNN model is also validated by transferring to bearings undergoing different operating conditions.

Building performance has been shown to degrade significantly after commissioning, resulting in increased energy consumption and associated greenhouse gas emissions. Continuous Commissioning using existing sensor networks and IoT devices has the potential to minimize this waste by continually identifying system degradation and re-tuning control strategies to adapt to real building performance. Due to its significant contribution to greenhouse gas emissions, the performance of gas boiler systems for building heating is critical. A review of boiler performance studies has been used to develop a set of common faults and degraded performance conditions, which have been integrated into a MATLAB/Simulink emulator. This resulted in a labeled dataset with approximately 10,000 simulations of steady-state performance for each of 14 non-condensing boilers. The collected data is used for training and testing fault classification using K-nearest neighbour, Decision tree, Random Forest, and Support Vector Machines. The results show that the Support Vector Machines method gave the best prediction accuracy, consistently exceeding 90%, and generalization across multiple boilers is not possible due to low classification accuracy.

Deep Reinforcement Learning (or just "RL") is gaining popularity for industrial and research applications. However, it still suffers from some key limits slowing down its widespread adoption. Its performance is sensitive to initial conditions and non-determinism. To unlock those challenges, we propose a procedure for building ensembles of RL agents to efficiently build better local decisions toward long-term cumulated rewards. For the first time, hundreds of experiments have been done to compare different ensemble constructions procedures in 2 electricity control environments. We discovered an ensemble of 4 agents improves accumulated rewards by 46%, improves reproducibility by a factor of 3.6, and can naturally and efficiently train and predict in parallel on GPUs and CPUs.

We consider the offline reinforcement learning problem, where the aim is to learn a decision making policy from logged data. Offline RL -- particularly when coupled with (value) function approximation to allow for generalization in large or continuous state spaces -- is becoming increasingly relevant in practice, because it avoids costly and time-consuming online data collection and is well suited to safety-critical domains. Existing sample complexity guarantees for offline value function approximation methods typically require both (1) distributional assumptions (i.e., good coverage) and (2) representational assumptions (i.e., ability to represent some or all $Q$-value functions) stronger than what is required for supervised learning. However, the necessity of these conditions and the fundamental limits of offline RL are not well understood in spite of decades of research. This led Chen and Jiang (2019) to conjecture that concentrability (the most standard notion of coverage) and realizability (the weakest representation condition) alone are not sufficient for sample-efficient offline RL. We resolve this conjecture in the positive by proving that in general, even if both concentrability and realizability are satisfied, any algorithm requires sample complexity polynomial in the size of the state space to learn a non-trivial policy. Our results show that sample-efficient offline reinforcement learning requires either restrictive coverage conditions or representation conditions that go beyond supervised learning, and highlight a phenomenon called over-coverage which serves as a fundamental barrier for offline value function approximation methods. A consequence of our results for reinforcement learning with linear function approximation is that the separation between online and offline RL can be arbitrarily large, even in constant dimension.

Rankings have become the primary interface in two-sided online markets. Many have noted that the rankings not only affect the satisfaction of the users (e.g., customers, listeners, employers, travelers), but that the position in the ranking allocates exposure -- and thus economic opportunity -- to the ranked items (e.g., articles, products, songs, job seekers, restaurants, hotels). This has raised questions of fairness to the items, and most existing works have addressed fairness by explicitly linking item exposure to item relevance. However, we argue that any particular choice of such a link function may be difficult to defend, and we show that the resulting rankings can still be unfair. To avoid these shortcomings, we develop a new axiomatic approach that is rooted in principles of fair division. This not only avoids the need to choose a link function, but also more meaningfully quantifies the impact on the items beyond exposure. Our axioms of envy-freeness and dominance over uniform ranking postulate that for a fair ranking policy every item should prefer their own rank allocation over that of any other item, and that no item should be actively disadvantaged by the rankings. To compute ranking policies that are fair according to these axioms, we propose a new ranking objective related to the Nash Social Welfare. We show that the solution has guarantees regarding its envy-freeness, its dominance over uniform rankings for every item, and its Pareto optimality. In contrast, we show that conventional exposure-based fairness can produce large amounts of envy and have a highly disparate impact on the items. Beyond these theoretical results, we illustrate empirically how our framework controls the trade-off between impact-based individual item fairness and user utility.

We present a directed percolation inverse problem for diode networks: Given information about which pairs of nodes allow current to percolate from one to the other, can one find a configuration of diodes consistent with the observed currents? We implement a divide-and-concur iterative projection method for solving the problem and demonstrate the supremacy of our method over an exhaustive approach for nontrivial instances of the problem. We find that the problem is most difficult when some but not all of the percolation data are hidden, and that the most difficult networks to reconstruct generally are those for which the currents are most sensitive to the addition or removal of a single diode.

Nowadays, we are living in an era of extreme device heterogeneity. Despite the high variety of conventional CPU architectures, accelerator devices, such as GPUs and FPGAs, also appear in the foreground exploding the pool of available solutions to execute applications. However, choosing the appropriate device per application needs is an extremely challenging task due to the abstract relationship between hardware and software. Automatic optimization algorithms that are accurate are required to cope with the complexity and variety of current hardware and software. Optimal execution has always relied on time-consuming trial and error approaches. Machine learning (ML) and Natural Language Processing (NLP) has flourished over the last decade with research focusing on deep architectures. In this context, the use of natural language processing techniques to source code in order to conduct autotuning tasks is an emerging field of study. In this paper, we extend the work of Cummins et al., namely Deeptune, that tackles the problem of optimal device selection (CPU or GPU) for accelerated OpenCL kernels. We identify three major limitations of Deeptune and, based on these, we propose four different DNN models that provide enhanced contextual information of source codes. Experimental results show that our proposed methodology surpasses that of Cummins et al. work, providing up to 4\% improvement in prediction accuracy.

Advanced optimization algorithms such as Newton method and AdaGrad benefit from second order derivative or second order statistics to achieve better descent directions and faster convergence rates. At their heart, such algorithms need to compute the inverse or inverse square root of a matrix whose size is quadratic of the dimensionality of the search space. For high dimensional search spaces, the matrix inversion or inversion of square root becomes overwhelming which in turn demands for approximate methods. In this work, we propose a new matrix approximation method which divides a matrix into blocks and represents each block by one or two numbers. The method allows efficient computation of matrix inverse and inverse square root. We apply our method to AdaGrad in training deep neural networks. Experiments show encouraging results compared to the diagonal approximation.

In recent studies, the generalization properties for distributed learning and random features assumed the existence of the target concept over the hypothesis space. However, this strict condition is not applicable to the more common non-attainable case. In this paper, using refined proof techniques, we first extend the optimal rates for distributed learning with random features to the non-attainable case. Then, we reduce the number of required random features via data-dependent generating strategy, and improve the allowed number of partitions with additional unlabeled data. Theoretical analysis shows these techniques remarkably reduce computational cost while preserving the optimal generalization accuracy under standard assumptions. Finally, we conduct several experiments on both simulated and real-world datasets, and the empirical results validate our theoretical findings.

Quantization is a technique to reduce the computation and memory cost of DNN models, which are getting increasingly large. Existing quantization solutions use fixed-point integer or floating-point types, which have limited benefits, as both require more bits to maintain the accuracy of original models. On the other hand, variable-length quantization uses low-bit quantization for normal values and high-precision for a fraction of outlier values. Even though this line of work brings algorithmic benefits, it also introduces significant hardware overheads due to variable-length encoding and decoding. In this work, we propose a fixed-length adaptive numerical data type called ANT to achieve low-bit quantization with tiny hardware overheads. Our data type ANT leverages two key innovations to exploit the intra-tensor and inter-tensor adaptive opportunities in DNN models. First, we propose a particular data type, flint, that combines the advantages of float and int for adapting to the importance of different values within a tensor. Second, we propose an adaptive framework that selects the best type for each tensor according to its distribution characteristics. We design a unified processing element architecture for ANT and show its ease of integration with existing DNN accelerators. Our design results in 2.8$\times$ speedup and 2.5$\times$ energy efficiency improvement over the state-of-the-art quantization accelerators.

In this paper, a new Discontinuity Capturing Shallow Neural Network (DCSNN) for approximating $d$-dimensional piecewise continuous functions and for solving elliptic interface problems is developed. There are three novel features in the present network; namely, (i) jump discontinuities are accurately captured, (ii) it is completely shallow, comprising only one hidden layer, (iii) it is completely mesh-free for solving partial differential equations. The crucial idea here is that a $d$-dimensional piecewise continuous function can be extended to a continuous function defined in $(d+1)$-dimensional space, where the augmented coordinate variable labels the pieces of each sub-domain. We then construct a shallow neural network to express this new function. Since only one hidden layer is employed, the number of training parameters (weights and biases) scales linearly with the dimension and the neurons used in the hidden layer. For solving elliptic interface problems, the network is trained by minimizing the mean square error loss that consists of the residual of the governing equation, boundary condition, and the interface jump conditions. We perform a series of numerical tests to demonstrate the accuracy of the present network. Our DCSNN model is efficient due to only a moderate number of parameters needed to be trained (a few hundred parameters used throughout all numerical examples), and the results indicate good accuracy. Compared with the results obtained by the traditional grid-based immersed interface method (IIM), which is designed particularly for elliptic interface problems, our network model shows a better accuracy than IIM. We conclude by solving a six-dimensional problem to demonstrate the capability of the present network for high-dimensional applications.

We prove that natural gradient descent, with respect to the parameters of a machine learning policy, admits a conjugate dynamical description consistent with evolution by natural selection. We characterize these conjugate dynamics as a locally optimal fit to the continuous-time replicator dynamics, and show that the Price equation applies to equivalence classes of functions belonging to a Hilbert space generated by the policy's architecture and parameters. We posit that "conjugate natural selection" intuitively explains the empirical effectiveness of natural gradient descent, while developing a useful analytic approach to the dynamics of machine learning.

Texture-based classification solutions have proven their significance in many domains, from industrial inspections to health-related applications. New methods have been developed based on texture feature learning and CNN-based architectures to address computer vision use cases for images with rich texture-based features. In recent years, architectures solving texture-based classification problems and demonstrating state-of-the-art results have emerged. Yet, one limitation of these approaches is that they cannot claim to be suitable for all types of image texture patterns. Each technique has an advantage for a specific texture type only. To address this shortcoming, we propose a framework that combines more than one texture-based techniques together, uniquely, with a CNN backbone to extract the most relevant texture features. This enables the model to be trained in a self-selective manner and produce improved results over current published benchmarks -- with almost same number of model parameters. Our proposed framework works well on most texture types simultaneously and allows flexibility for additional texture-based methods to be accommodated to achieve better results than existing architectures. In this work, firstly, we present an analysis on the relative importance of existing techniques when used alone and in combination with other TE methods on benchmark datasets. Secondly, we show that Global Average Pooling which represents the spatial information -- is of less significance in comparison to the TE method(s) applied in the network while training for texture-based classification tasks. Finally, we present state-of-the-art results for several texture-based benchmark datasets by combining three existing texture-based techniques using our proposed framework.

In this paper we present a general framework for estimating regression models subject to a user-defined level of fairness. We enforce fairness as a model selection step in which we choose the value of a ridge penalty to control the effect of sensitive attributes. We then estimate the parameters of the model conditional on the chosen penalty value. Our proposal is mathematically simple, with a solution that is partly in closed form, and produces estimates of the regression coefficients that are intuitive to interpret as a function of the level of fairness. Furthermore, it is easily extended to generalised linear models, kernelised regression models and other penalties; and it can accommodate multiple definitions of fairness. We compare our approach with the regression model from Komiyama et al. (2018), which implements a provably-optimal linear regression model; and with the fair models from Zafar et al. (2019). We evaluate these approaches empirically on six different data sets, and we find that our proposal provides better goodness of fit and better predictive accuracy for the same level of fairness. In addition, we highlight a source of bias in the original experimental evaluation in Komiyama et al. (2018).

Interpretability of deep learning is widely used to evaluate the reliability of medical imaging models and reduce the risks of inaccurate patient recommendations. For models exceeding human performance, e.g. predicting RNA structure from microscopy images, interpretable modelling can be further used to uncover highly non-trivial patterns which are otherwise imperceptible to the human eye. We show that interpretability can reveal connections between the microscopic appearance of cancer tissue and its gene expression profiling. While exhaustive profiling of all genes from the histology images is still challenging, we estimate the expression values of a well-known subset of genes that is indicative of cancer molecular subtype, survival, and treatment response in colorectal cancer. Our approach successfully identifies meaningful information from the image slides, highlighting hotspots of high gene expression. Our method can help characterise how gene expression shapes tissue morphology and this may be beneficial for patient stratification in the pathology unit. The code is available on GitHub.

We propose a methodology to predict the cardiac epicardial and mediastinal fat volumes in computed tomography images using regression algorithms. The obtained results indicate that it is feasible to predict these fats with a high degree of correlation, thus alleviating the requirement for manual or automatic segmentation of both fat volumes. Instead, segmenting just one of them suffices, while the volume of the other may be predicted fairly precisely. The correlation coefficient obtained by the Rotation Forest algorithm using MLP Regressor for predicting the mediastinal fat based on the epicardial fat was 0.9876, with a relative absolute error of 14.4% and a root relative squared error of 15.7%. The best correlation coefficient obtained in the prediction of the epicardial fat based on the mediastinal was 0.9683 with a relative absolute error of 19.6% and a relative squared error of 24.9%. Moreover, we analysed the feasibility of using linear regressors, which provide an intuitive interpretation of the underlying approximations. In this case, the obtained correlation coefficient was 0.9534 for predicting the mediastinal fat based on the epicardial, with a relative absolute error of 31.6% and a root relative squared error of 30.1%. On the prediction of the epicardial fat based on the mediastinal fat, the correlation coefficient was 0.8531, with a relative absolute error of 50.43% and a root relative squared error of 52.06%. In summary, it is possible to speed up general medical analyses and some segmentation and quantification methods that are currently employed in the state-of-the-art by using this prediction approach, which consequently reduces costs and therefore enables preventive treatments that may lead to a reduction of health problems.

We study the prices of European Emission Allowances (EUA), whereby we analyze their uncertainty and dependencies on related energy markets. We propose a probabilistic multivariate conditional time series model that exploits key characteristics of the data. The forecasting performance of the proposed model and various competing models is evaluated in an extensive rolling window forecasting study, covering almost two years out-of-sample. Thereby, we forecast 30-steps ahead. The accuracy of the multivariate probabilistic forecasts is assessed by the energy score. We discuss our findings focusing on volatility spillovers and time-varying correlations, also in view of the Russian invasion of Ukraine.

In this paper, we introduce MCTensor, a library based on PyTorch for providing general-purpose and high-precision arithmetic for DL training. MCTensor is used in the same way as PyTorch Tensor: we implement multiple basic, matrix-level computation operators and NN modules for MCTensor with identical PyTorch interface. Our algorithms achieve high precision computation and also benefits from heavily-optimized PyTorch floating-point arithmetic. We evaluate MCTensor arithmetic against PyTorch native arithmetic for a series of tasks, where models using MCTensor in float16 would match or outperform the PyTorch model with float32 or float64 precision.

Can a machine learn machine learning? We propose to answer this question using the same criteria we use to answer a similar question: can a human learn machine learning? We automatically answer MIT final exams in Introduction to Machine Learning at a human level. The course is a large undergraduate class with around five hundred students each semester. Recently, program synthesis and few-shot learning solved university-level problem set questions in mathematics and STEM courses at a human level. In this work, we solve questions from final exams that differ from problem sets in several ways: the questions are longer, have multiple parts, are more complicated, and span a broader set of topics. We provide a new dataset and benchmark of questions from eight MIT Introduction to Machine Learning final exams between Fall 2017 and Spring 2022 and provide code for automatically answering these questions and generating new questions. We perform ablation studies comparing zero-shot learning with few-shot learning, chain-of-thought prompting, GPT-3 pre-trained on text and Codex fine-tuned on code on a range of machine learning topics and find that few-shot learning methods perform best. We make our data and code publicly available for the machine learning community.

While sample efficiency is the main motive for use of Bayesian optimisation when black-box functions are expensive to evaluate, the standard approach based on type II maximum likelihood (ML-II) may fail and result in disappointing performance in small-sample trials. The paper provides three compelling reasons to adopt fully Bayesian optimisation (FBO) as an alternative. First, failures of ML-II are more commonplace than implied by the existing studies using the contrived settings. Second, FBO is more robust than ML-II, and the price of robustness is almost trivial. Third, FBO has become simple to implement and fast enough to be practical. The paper supports the argument using relevant experiments, which reflect the current practice regarding models, algorithms, and software platforms. Since the benefits seem to outweigh the costs, researchers should consider adopting FBO for their applications so that they can guard against potential failures that end up wasting precious research resources.

This paper attempts to establish the theoretical foundation for the emerging super-model paradigm via domain adaptation, where one first trains a very large-scale model, {\it i.e.}, super model (or foundation model in some other papers), on a large amount of data and then adapts it to various specific domains. Super-model paradigms help reduce computational and data cost and carbon emission, which is critical to AI industry, especially enormous small and medium-sized enterprises. We model the super-model paradigm as a two-stage diffusion process: (1) in the pre-training stage, the model parameter diffuses from random initials and converges to a steady distribution; and (2) in the fine-tuning stage, the model parameter is transported to another steady distribution. Both training stages can be mathematically modeled by the Uhlenbeck-Ornstein process which converges to two Maxwell-Boltzmann distributions, respectively, each of which characterizes the corresponding convergent model. An $\mathcal O(1/\sqrt{N})$ generalization bound is then established via PAC-Bayesian framework. The theory finds that the generalization error of the fine-tuning stage is dominant in domain adaptation. In addition, our theory suggests that the generalization is determined by a new measure that characterizes the domain discrepancy between the source domain and target domain, based on the covariance matrices and the shift of the converged local minimum.

This review addresses the problem of learning abstract representations of the measurement data in the context of Deep Reinforcement Learning (DRL). While the data are often ambiguous, high-dimensional, and complex to interpret, many dynamical systems can be effectively described by a low-dimensional set of state variables. Discovering these state variables from the data is a crucial aspect for improving the data efficiency, robustness and generalization of DRL methods, tackling the curse of dimensionality, and bringing interpretability and insights into black-box DRL. This review provides a comprehensive and complete overview of unsupervised representation learning in DRL by describing the main Deep Learning tools used for learning representations of the world, providing a systematic view of the method and principles, summarizing applications, benchmarks and evaluation strategies, and discussing open challenges and future directions.

The quantification of fat depots on the surroundings of the heart is an accurate procedure for evaluating health risk factors correlated with several diseases. However, this type of evaluation is not widely employed in clinical practice due to the required human workload. This work proposes a novel technique for the automatic segmentation of cardiac fat pads. The technique is based on applying classification algorithms to the segmentation of cardiac CT images. Furthermore, we extensively evaluate the performance of several algorithms on this task and discuss which provided better predictive models. Experimental results have shown that the mean accuracy for the classification of epicardial and mediastinal fats has been 98.4% with a mean true positive rate of 96.2%. On average, the Dice similarity index, regarding the segmented patients and the ground truth, was equal to 96.8%. Therfore, our technique has achieved the most accurate results for the automatic segmentation of cardiac fats, to date.

In our experience of working with domain experts who are using today's AutoML systems, a common problem we encountered is what we call "unrealistic expectations" -- when users are facing a very challenging task with a noisy data acquisition process, while being expected to achieve startlingly high accuracy with machine learning (ML). Many of these are predestined to fail from the beginning. In traditional software engineering, this problem is addressed via a feasibility study, an indispensable step before developing any software system. In this paper, we present Snoopy, with the goal of supporting data scientists and machine learning engineers performing a systematic and theoretically founded feasibility study before building ML applications. We approach this problem by estimating the irreducible error of the underlying task, also known as the Bayes error rate (BER), which stems from data quality issues in datasets used to train or evaluate ML model artifacts. We design a practical Bayes error estimator that is compared against baseline feasibility study candidates on 6 datasets (with additional real and synthetic noise of different levels) in computer vision and natural language processing. Furthermore, by including our systematic feasibility study with additional signals into the iterative label cleaning process, we demonstrate in end-to-end experiments how users are able to save substantial labeling time and monetary efforts.

Strong gravitational lensing has emerged as a promising approach for probing dark matter models on sub-galactic scales. Recent work has proposed the subhalo effective density slope as a more reliable observable than the commonly used subhalo mass function. The subhalo effective density slope is a measurement independent of assumptions about the underlying density profile and can be inferred for individual subhalos through traditional sampling methods. To go beyond individual subhalo measurements, we leverage recent advances in machine learning and introduce a neural likelihood-ratio estimator to infer an effective density slope for populations of subhalos. We demonstrate that our method is capable of harnessing the statistical power of multiple subhalos (within and across multiple images) to distinguish between characteristics of different subhalo populations. The computational efficiency warranted by the neural likelihood-ratio estimator over traditional sampling enables statistical studies of dark matter perturbers and is particularly useful as we expect an influx of strong lensing systems from upcoming surveys.

Multi-source domain adaptation (MSDA) learns to predict the labels in target domain data, under the setting where all data from multiple source domains are labelled and the data from the target domain are unlabeled. To handle this problem, most of methods focus on learning invariant representations across domains. However, their success severely relies on the assumption that label distribution remains unchanged across domains. To mitigate it, we propose a new assumption, latent covariate shift, where the marginal distribution of the latent content variable changes across domains, and the conditional distribution of the label given the latent content remains invariant across domains. We introduce a latent style variable to complement the latent content variable forming a latent causal graph as the data and label generating process. We show that although the latent style variable is unidentifiable due to transitivity property in the latent space, the latent content variable can be identified up to simple scaling under some mild conditions. This motivates us to propose a novel method for MSDA, which learns the invariant label distribution conditional on the latent content variable, instead of learning invariant representations. Empirical evaluation on simulation and real data demonstrates the effectiveness of the proposed method, compared with many state-of-the-art methods based on invariant representation.

Diffusion models are a class of generative models, showing superior performance as compared to other generative models in creating realistic images when trained on natural image datasets. We introduce DISPR, a diffusion-based model for solving the inverse problem of three-dimensional (3D) cell shape prediction from two-dimensional (2D) single cell microscopy images. Using the 2D microscopy image as a prior, DISPR is conditioned to predict realistic 3D shape reconstructions. To showcase the applicability of DISPR as a data augmentation tool in a feature-based single cell classification task, we extract morphological features from the cells grouped into six highly imbalanced classes. Adding features from predictions of DISPR to the three minority classes improved the macro F1 score from $F1_\text{macro} = 55.2 \pm 4.6\%$ to $F1_\text{macro} = 72.2 \pm 4.9\%$. With our method being the first to employ a diffusion-based model in this context, we demonstrate that diffusion models can be applied to inverse problems in 3D, and that they learn to reconstruct 3D shapes with realistic morphological features from 2D microscopy images.

While self-supervised learning has been shown to benefit a number of vision tasks, existing techniques mainly focus on image-level manipulation, which may not generalize well to downstream tasks at patch or pixel levels. Moreover, existing SSL methods might not sufficiently describe and associate the above representations within and across image scales. In this paper, we propose a Self-Supervised Pyramid Representation Learning (SS-PRL) framework. The proposed SS-PRL is designed to derive pyramid representations at patch levels via learning proper prototypes, with additional learners to observe and relate inherent semantic information within an image. In particular, we present a cross-scale patch-level correlation learning in SS-PRL, which allows the model to aggregate and associate information learned across patch scales. We show that, with our proposed SS-PRL for model pre-training, one can easily adapt and fine-tune the models for a variety of applications including multi-label classification, object detection, and instance segmentation.

Detecting anomalous regions in images is a frequently encountered problem in industrial monitoring. A relevant example is the analysis of tissues and other products that in normal conditions conform to a specific texture, while defects introduce changes in the normal pattern. We address the anomaly detection problem by training a deep autoencoder, and we show that adopting a loss function based on Complex Wavelet Structural Similarity (CW-SSIM) yields superior detection performance on this type of images compared to traditional autoencoder loss functions. Our experiments on well-known anomaly detection benchmarks show that a simple model trained with this loss function can achieve comparable or superior performance to state-of-the-art methods leveraging deeper, larger and more computationally demanding neural networks.

Causal representation learning exposes latent high-level causal variables behind low-level observations, which has enormous potential for a set of downstream tasks of interest. Despite this, identifying the true latent causal representation from observed data is a great challenge. In this work we focus on identifying latent causal variables. To this end, we analysis three intrinsic properties in latent space, including transitivity, permutation and scaling. We show that the transitivity severely hinders the identifiability of latent causal variables, while permutation and scaling guide the direction of identifying latent causal variable. To break the transitivity, we assume the underlying latent causal relations to be linear Gaussian models, in which the weights, mean and variance of Gaussian noise are modulated by an additionally observed variable. Under these assumptions we theoretically show that the latent causal variables can be identifiable up to trivial permutation and scaling. Built on this theoretical result, we propose a novel method, termed Structural caUsAl Variational autoEncoder, which directly learns latent causal variables, together with the mapping from the latent causal variables to the observed ones. Experimental results on synthetic and real data demonstrate the identifiable result and the ability of the proposed method for learning latent causal variables.

We revisit the classical kernel method of approximation/interpolation theory in a very specific context motivated by the desire to obtain a robust procedure to approximate discrete data sets by (super)level sets of functions that are merely continuous at the data set arguments but are otherwise smooth. Special functions, called data signals, are defined for any given data set and are used to succesfully solve supervised classification problems in a robust way that depends continuously on the data set. The efficacy of the method is illustrated with a series of low dimensional examples and by its application to the standard benchmark high dimensional problem of MNIST digit classification.

In this paper, we propose to solve a regularized distributionally robust learning problem in the decentralized setting, taking into account the data distribution shift. By adding a Kullback-Liebler regularization function to the robust min-max optimization problem, the learning problem can be reduced to a modified robust minimization problem and solved efficiently. Leveraging the newly formulated optimization problem, we propose a robust version of Decentralized Stochastic Gradient Descent (DSGD), coined Distributionally Robust Decentralized Stochastic Gradient Descent (DR-DSGD). Under some mild assumptions and provided that the regularization parameter is larger than one, we theoretically prove that DR-DSGD achieves a convergence rate of $\mathcal{O}\left(1/\sqrt{KT} + K/T\right)$, where $K$ is the number of devices and $T$ is the number of iterations. Simulation results show that our proposed algorithm can improve the worst distribution test accuracy by up to $10\%$. Moreover, DR-DSGD is more communication-efficient than DSGD since it requires fewer communication rounds (up to $20$ times less) to achieve the same worst distribution test accuracy target. Furthermore, the conducted experiments reveal that DR-DSGD results in a fairer performance across devices in terms of test accuracy.

Neural networks are powerful surrogates for numerous forward processes. The inversion of such surrogates is extremely valuable in science and engineering. The most important property of a successful neural inverse method is the performance of its solutions when deployed in the real world, i.e., on the native forward process (and not only the learned surrogate). We propose Autoinverse, a highly automated approach for inverting neural network surrogates. Our main insight is to seek inverse solutions in the vicinity of reliable data which have been sampled form the forward process and used for training the surrogate model. Autoinverse finds such solutions by taking into account the predictive uncertainty of the surrogate and minimizing it during the inversion. Apart from high accuracy, Autoinverse enforces the feasibility of solutions, comes with embedded regularization, and is initialization free. We verify our proposed method through addressing a set of real-world problems in control, fabrication, and design.

Persistent homology (PH) is one of the most popular methods in Topological Data Analysis. Even though PH has been used in many different types of applications, the reasons behind its success remain elusive; in particular, it is not known for which classes of problems it is most effective, or to what extent it can detect geometric or topological features. The goal of this work is to identify some types of problems where PH performs well or even better than other methods in data analysis. We consider three fundamental shape analysis tasks: the detection of the number of holes, curvature and convexity from 2D and 3D point clouds sampled from shapes. Experiments demonstrate that PH is successful in these tasks, outperforming several baselines, including PointNet, an architecture inspired precisely by the properties of point clouds. In addition, we observe that PH remains effective for limited computational resources and limited training data, as well as out-of-distribution test data, including various data transformations and noise. For convexity detection, we provide a theoretical guarantee that PH is effective for this task, and demonstrate the detection of a convexity measure on the FLAVIA dataset of plant leaf images.

For environmental, sustainable economic and political reasons, recycling processes are becoming increasingly important, aiming at a much higher use of secondary raw materials. Currently, for the copper and aluminium industries, no method for the non-destructive online analysis of heterogeneous materials are available. The Promt Gamma Neutron Activation Analysis (PGNAA) has the potential to overcome this challenge. A difficulty when using PGNAA for real-time classification arises from the small amount of noisy data, due to short-term measurements. In this case, classical evaluation methods using detailed peak by peak analysis fail. Therefore, we propose to view spectral data as probability distributions. Then, we can classify material using maximum log-likelihood with respect to kernel density estimation and use discrete sampling to optimize hyperparameters. For measurements of pure aluminium alloys we achieve near perfect classification of aluminium alloys under 0.25 second.

First Rosenblatt's theorem about omnipotence of shallow networks states that elementary perceptrons can solve any classification problem if there are no discrepancies in the training set. Minsky and Papert considered elementary perceptrons with restrictions on the neural inputs: a bounded number of connections or a relatively small diameter of the receptive field for each neuron at the hidden layer. They proved that under these constraints, an elementary perceptron cannot solve some problems, such as the connectivity of input images or the parity of pixels in them. In this note, we demonstrated first Rosenblatt's theorem at work, showed how an elementary perceptron can solve a version of the travel maze problem, and analysed the complexity of that solution. We constructed also a deep network algorithm for the same problem. It is much more efficient. The shallow network uses an exponentially large number of neurons on the hidden layer (Rosenblatt's $A$-elements), whereas for the deep network the second order polynomial complexity is sufficient. We demonstrated that for the same complex problem deep network can be much smaller and reveal a heuristic behind this effect.

This paper presents an approach to assess the perfusion of visible human tissue from RGB video files. We propose metrics derived from remote photoplethysmography (rPPG) signals to detect whether a tissue is adequately supplied with blood. The perfusion analysis is done in three different scales, offering a flexible approach for different applications. We perform a plane-orthogonal-to-skin rPPG independently for locally defined regions of interest on each scale. From the extracted signals, we derive the signal-to-noise ratio, magnitude in the frequency domain, heart rate, perfusion index as well as correlation between specific rPPG signals in order to locally assess the perfusion of a specific region of human tissue. We show that locally resolved rPPG has a broad range of applications. As exemplary applications, we present results in intraoperative perfusion analysis and visualization during skin and organ transplantation as well as an application for liveliness assessment for the detection of presentation attacks to authentication systems.

Many methods for Model-based Reinforcement learning (MBRL) provide guarantees for both the accuracy of the Markov decision process (MDP) model they can deliver and the learning efficiency. At the same time, state abstraction techniques allow for a reduction of the size of an MDP while maintaining a bounded loss with respect to the original problem. It may come as a surprise, therefore, that no such guarantees are available when combining both techniques, i.e., where MBRL merely observes abstract states. Our theoretical analysis shows that abstraction can introduce a dependence between samples collected online (e.g., in the real world), which means that most results for MBRL can not be directly extended to this setting. The new results in this work show that concentration inequalities for martingales can be used to overcome this problem and allows for extending the results of algorithms such as R-MAX to the setting with abstraction. Thus producing the first performance guarantees for Abstracted RL: model-based reinforcement learning with an abstracted model.

Current approaches for points-of-interest (POI) recommendation learn the preferences of a user via the standard spatial features such as the POI coordinates, the social network, etc. These models ignore a crucial aspect of spatial mobility -- every user carries their smartphones wherever they go. In addition, with growing privacy concerns, users refrain from sharing their exact geographical coordinates and their social media activity. In this paper, we present REVAMP, a sequential POI recommendation approach that utilizes the user activity on smartphone applications (or apps) to identify their mobility preferences. This work aligns with the recent psychological studies of online urban users, which show that their spatial mobility behavior is largely influenced by the activity of their smartphone apps. In addition, our proposal of coarse-grained smartphone data refers to data logs collected in a privacy-conscious manner, i.e., consisting only of (a) category of the smartphone app and (b) category of check-in location. Thus, REVAMP is not privy to precise geo-coordinates, social networks, or the specific application being accessed. Buoyed by the efficacy of self-attention models, we learn the POI preferences of a user using two forms of positional encodings -- absolute and relative -- with each extracted from the inter-check-in dynamics in the check-in sequence of a user. Extensive experiments across two large-scale datasets from China show the predictive prowess of REVAMP and its ability to predict app- and POI categories.

The next-generation wireless networks are required to satisfy a variety of services and criteria concurrently. To address upcoming strict criteria, a new open radio access network (O-RAN) with distinguishing features such as flexible design, disaggregated virtual and programmable components, and intelligent closed-loop control was developed. O-RAN slicing is being investigated as a critical strategy for ensuring network quality of service (QoS) in the face of changing circumstances. However, distinct network slices must be dynamically controlled to avoid service level agreement (SLA) variation caused by rapid changes in the environment. Therefore, this paper introduces a novel framework able to manage the network slices through provisioned resources intelligently. Due to diverse heterogeneous environments, intelligent machine learning approaches require sufficient exploration to handle the harshest situations in a wireless network and accelerate convergence. To solve this problem, a new solution is proposed based on evolutionary-based deep reinforcement learning (EDRL) to accelerate and optimize the slice management learning process in the radio access network's (RAN) intelligent controller (RIC) modules. To this end, the O-RAN slicing is represented as a Markov decision process (MDP) which is then solved optimally for resource allocation to meet service demand using the EDRL approach. In terms of reaching service demands, simulation results show that the proposed approach outperforms the DRL baseline by 62.2%.

Deep generative models (DGMs) are data-eager. Essentially, it is because learning a complex model on limited data suffers from a large variance and easily overfits. Inspired by the \emph{bias-variance dilemma}, we propose \emph{regularized deep generative model} (Reg-DGM), which leverages a nontransferable pre-trained model to reduce the variance of generative modeling with limited data. Formally, Reg-DGM optimizes a weighted sum of a certain divergence between the data distribution and the DGM and the expectation of an energy function defined by the pre-trained model w.r.t. the DGM. Theoretically, we characterize the existence and uniqueness of the global minimum of Reg-DGM in the nonparametric setting and rigorously prove the statistical benefits of Reg-DGM w.r.t. the mean squared error and the expected risk in a simple yet representative Gaussian-fitting example. Empirically, it is quite flexible to specify the DGM and the pre-trained model in Reg-DGM. In particular, with a ResNet-18 classifier pre-trained on ImageNet and a data-dependent energy function, Reg-DGM consistently improves the generation performance of strong DGMs including StyleGAN2 and ADA on several benchmarks with limited data and achieves competitive results to the state-of-the-art methods.

Bilinear dynamical systems are ubiquitous in many different domains and they can also be used to approximate more general control-affine systems. This motivates the problem of learning bilinear systems from a single trajectory of the system's states and inputs. Under a mild marginal mean-square stability assumption, we identify how much data is needed to estimate the unknown bilinear system up to a desired accuracy with high probability. Our sample complexity and statistical error rates are optimal in terms of the trajectory length, the dimensionality of the system and the input size. Our proof technique relies on an application of martingale small-ball condition. This enables us to correctly capture the properties of the problem, specifically our error rates do not deteriorate with increasing instability. Finally, we show that numerical experiments are well-aligned with our theoretical results.

The performance of machine learning models can significantly degrade under distribution shifts of the data. We propose a new method for classification which can improve robustness to distribution shifts, by combining expert knowledge about the ``high-level" structure of the data with standard classifiers. Specifically, we introduce two-stage classifiers called memory classifiers. First, these identify prototypical data points -- memories -- to cluster the training data. This step is based on features designed with expert guidance; for instance, for image data they can be extracted using digital image processing algorithms. Then, within each cluster, we learn local classifiers based on finer discriminating features, via standard models like deep neural networks. We establish generalization bounds for memory classifiers. We illustrate in experiments that they can improve generalization and robustness to distribution shifts on image datasets. We show improvements which push beyond standard data augmentation techniques.

Prediction of individuals' race and ethnicity plays an important role in studies of racial disparity. Bayesian Improved Surname Geocoding (BISG), which relies on detailed Census information, has emerged as a leading methodology for this prediction task. Unfortunately, BISG suffers from two data problems. First, the Census often contains zero counts for minority groups in the locations where members of those groups reside. Second, many surnames -- especially those of minorities -- are missing from the Census data. We introduce a fully Bayesian Improved Surname Geocoding (fBISG) methodology that accounts for Census measurement error by extending the naive Bayesian inference of the BISG methodology. We also use additional data on last, first, and middle names taken from the voter files of six Southern states where self-reported race is available. Our empirical validation shows that the fBISG methodology and name supplements significantly improve the accuracy of race imputation, especially for racial minorities.

The manufacturing sector is envisioned to be heavily influenced by artificial intelligence-based technologies with the extraordinary increases in computational power and data volumes. A central challenge in manufacturing sector lies in the requirement of a general framework to ensure satisfied diagnosis and monitoring performances in different manufacturing applications. Here we propose a general data-driven, end-to-end framework for the monitoring of manufacturing systems. This framework, derived from deep learning techniques, evaluates fused sensory measurements to detect and even predict faults and wearing conditions. This work exploits the predictive power of deep learning to automatically extract hidden degradation features from noisy, time-course data. We have experimented the proposed framework on ten representative datasets drawn from a wide variety of manufacturing applications. Results reveal that the framework performs well in examined benchmark applications and can be applied in diverse contexts, indicating its potential use as a critical corner stone in smart manufacturing.

This work proposes the use of Genetic Algorithms (GA) in tracing and recognizing the pericardium contour of the human heart using Computed Tomography (CT) images. We assume that each slice of the pericardium can be modelled by an ellipse, the parameters of which need to be optimally determined. An optimal ellipse would be one that closely follows the pericardium contour and, consequently, separates appropriately the epicardial and mediastinal fats of the human heart. Tracing and automatically identifying the pericardium contour aids in medical diagnosis. Usually, this process is done manually or not done at all due to the effort required. Besides, detecting the pericardium may improve previously proposed automated methodologies that separate the two types of fat associated to the human heart. Quantification of these fats provides important health risk marker information, as they are associated with the development of certain cardiovascular pathologies. Finally, we conclude that GA offers satisfiable solutions in a feasible amount of processing time.

The availability of large scale data with high quality ground truth labels is a challenge when developing supervised machine learning solutions for healthcare domain. Although, the amount of digital data in clinical workflows is increasing, most of this data is distributed on clinical sites and protected to ensure patient privacy. Radiological readings and dealing with large-scale clinical data puts a significant burden on the available resources, and this is where machine learning and artificial intelligence play a pivotal role. Magnetic Resonance Imaging (MRI) for musculoskeletal (MSK) diagnosis is one example where the scans have a wealth of information, but require a significant amount of time for reading and labeling. Self-supervised learning (SSL) can be a solution for handling the lack of availability of ground truth labels, but generally requires a large amount of training data during the pretraining stage. Herein, we propose a slice-based self-supervised deep learning framework (SB-SSL), a novel slice-based paradigm for classifying abnormality using knee MRI scans. We show that for a limited number of cases (<1000), our proposed framework is capable to identify anterior cruciate ligament tear with an accuracy of 89.17% and an AUC of 0.954, outperforming state-of-the-art without usage of external data during pretraining. This demonstrates that our proposed framework is suited for SSL in the limited data regime.

Big data mining is well known to be an important task for data science, because it can provide useful observations and new knowledge hidden in given large datasets. Proximity-based data analysis is particularly utilized in many real-life applications. In such analysis, the distances to k nearest neighbors are usually employed, thus its main bottleneck is derived from data retrieval. Much efforts have been made to improve the efficiency of these analyses. However, they still incur large costs, because they essentially need many data accesses. To avoid this issue, we propose a machine-learning technique that quickly and accurately estimates the k-NN distances (i.e., distances to the k nearest neighbors) of a given query. We train a fully connected neural network model and utilize pivots to achieve accurate estimation. Our model is designed to have useful advantages: it infers distances to the k-NNs at a time, its inference time is O(1) (no data accesses are incurred), but it keeps high accuracy. Our experimental results and case studies on real datasets demonstrate the efficiency and effectiveness of our solution.

One of the most fundamental problems in machine learning is to compare examples: Given a pair of objects we want to return a value which indicates degree of (dis)similarity. Similarity is often task specific, and pre-defined distances can perform poorly, leading to work in metric learning. However, being able to learn a similarity-sensitive distance function also presupposes access to a rich, discriminative representation for the objects at hand. In this dissertation we present contributions towards both ends. In the first part of the thesis, assuming good representations for the data, we present a formulation for metric learning that makes a more direct attempt to optimize for the k-NN accuracy as compared to prior work. We also present extensions of this formulation to metric learning for kNN regression, asymmetric similarity learning and discriminative learning of Hamming distance. In the second part, we consider a situation where we are on a limited computational budget i.e. optimizing over a space of possible metrics would be infeasible, but access to a label aware distance metric is still desirable. We present a simple, and computationally inexpensive approach for estimating a well motivated metric that relies only on gradient estimates, discussing theoretical and experimental results. In the final part, we address representational issues, considering group equivariant convolutional neural networks (GCNNs). Equivariance to symmetry transformations is explicitly encoded in GCNNs; a classical CNN being the simplest example. In particular, we present a SO(3)-equivariant neural network architecture for spherical data, that operates entirely in Fourier space, while also providing a formalism for the design of fully Fourier neural networks that are equivariant to the action of any continuous compact group.

The lung airway tree modeling is essential to work for the diagnosis of pulmonary diseases, especially for X-Ray computed tomography (CT). The airway tree modeling on CT images can provide the experts with 3-dimension measurements like wall thickness, etc. This information can tremendously aid the diagnosis of pulmonary diseases like chronic obstructive pulmonary disease [1-4]. Many scholars have attempted various ways to model the lung airway tree, which can be split into two major categories based on its nature. Namely, the model-based approach and the deep learning approach. The performance of a typical model-based approach usually depends on the manual tuning of the model parameter, which can be its advantages and disadvantages. The advantage is its don't require a large amount of training data which can be beneficial for a small dataset like medical imaging. On the other hand, the performance of model-based may be a misconcep-tion [5,6]. In recent years, deep learning has achieved good results in the field of medical image processing, and many scholars have used UNet-based methods in medical image segmentation [7-11]. Among all the variation of UNet, the UNet 3+ [11] have relatively good result compare to the rest of the variation of UNet. Therefor to further improve the accuracy of lung airway tree modeling, this study combines the Frangi filter [5] with UNet 3+ [11] to develop a dual-channel 3D UNet 3+. The Frangi filter is used to extracting vessel-like feature. The vessel-like feature then used as input to guide the dual-channel UNet 3+ training and testing procedures.

Representation learning on temporal graphs has drawn considerable research attention owing to its fundamental importance in a wide spectrum of real-world applications. Though a number of studies succeed in obtaining time-dependent representations, it still faces significant challenges. On the one hand, most of the existing methods restrict the embedding space with a certain curvature. However, the underlying geometry in fact shifts among the positive curvature hyperspherical, zero curvature Euclidean and negative curvature hyperbolic spaces in the evolvement over time. On the other hand, these methods usually require abundant labels to learn temporal representations, and thereby notably limit their wide use in the unlabeled graphs of the real applications. To bridge this gap, we make the first attempt to study the problem of self-supervised temporal graph representation learning in the general Riemannian space, supporting the time-varying curvature to shift among hyperspherical, Euclidean and hyperbolic spaces. In this paper, we present a novel self-supervised Riemannian graph neural network (SelfRGNN). Specifically, we design a curvature-varying Riemannian GNN with a theoretically grounded time encoding, and formulate a functional curvature over time to model the evolvement shifting among the positive, zero and negative curvature spaces. To enable the self-supervised learning, we propose a novel reweighting self-contrastive approach, exploring the Riemannian space itself without augmentation, and propose an edge-based self-supervised curvature learning with the Ricci curvature. Extensive experiments show the superiority of SelfRGNN, and moreover, the case study shows the time-varying curvature of temporal graph in reality.

Graphs are ubiquitous in encoding relational information of real-world objects in many domains. Graph generation, whose purpose is to generate new graphs from a distribution similar to the observed graphs, has received increasing attention thanks to the recent advances of deep learning models. In this paper, we conduct a comprehensive review on the existing literature of graph generation from a variety of emerging methods to its wide application areas. Specifically, we first formulate the problem of deep graph generation and discuss its difference with several related graph learning tasks. Secondly, we divide the state-of-the-art methods into three categories based on model architectures and summarize their generation strategies. Thirdly, we introduce three key application areas of deep graph generation. Lastly, we highlight challenges and opportunities in the future study of deep graph generation.

Many fundamental properties of a quantum system are captured by its Hamiltonian and ground state. Despite the significance of ground states preparation (GSP), this task is classically intractable for large-scale Hamiltonians. Quantum neural networks (QNNs), which exert the power of modern quantum machines, have emerged as a leading protocol to conquer this issue. As such, how to enhance the performance of QNNs becomes a crucial topic in GSP. Empirical evidence showed that QNNs with handcraft symmetric ansatzes generally experience better trainability than those with asymmetric ansatzes, while theoretical explanations have not been explored. To fill this knowledge gap, here we propose the effective quantum neural tangent kernel (EQNTK) and connect this concept with over-parameterization theory to quantify the convergence of QNNs towards the global optima. We uncover that the advance of symmetric ansatzes attributes to their large EQNTK value with low effective dimension, which requests few parameters and quantum circuit depth to reach the over-parameterization regime permitting a benign loss landscape and fast convergence. Guided by EQNTK, we further devise a symmetric pruning (SP) scheme to automatically tailor a symmetric ansatz from an over-parameterized and asymmetric one to greatly improve the performance of QNNs when the explicit symmetry information of Hamiltonian is unavailable. Extensive numerical simulations are conducted to validate the analytical results of EQNTK and the effectiveness of SP.

Needle-in-a-Haystack problems exist across a wide range of applications including rare disease prediction, ecological resource management, fraud detection, and material property optimization. A Needle-in-a-Haystack problem arises when there is an extreme imbalance of optimum conditions relative to the size of the dataset. For example, only 0.82% out of 146k total materials in the open-access Materials Project database have a negative Poisson's ratio. However, current state-of-the-art optimization algorithms are not designed with the capabilities to find solutions to these challenging multidimensional Needle-in-a-Haystack problems, resulting in slow convergence to a global optimum or pigeonholing into a local minimum. In this paper, we present a Zooming Memory-Based Initialization algorithm, entitled ZoMBI, that builds on conventional Bayesian optimization principles to quickly and efficiently optimize Needle-in-a-Haystack problems in both less time and fewer experiments by addressing the common convergence and pigeonholing issues. ZoMBI actively extracts knowledge from the previously best-performing evaluated experiments to iteratively zoom in the sampling search bounds towards the global optimum "needle" and then prunes the memory of low-performing historical experiments to accelerate compute times. We validate the algorithm's performance on two real-world 5-dimensional Needle-in-a-Haystack material property optimization datasets: discovery of auxetic Poisson's ratio materials and discovery of high thermoelectric figure of merit materials. The ZoMBI algorithm demonstrates compute time speed-ups of 400x compared to traditional Bayesian optimization as well as efficiently discovering materials in under 100 experiments that are up to 3x more highly optimized than those discovered by current state-of-the-art algorithms.

A growing body of work has shown that deep neural networks are susceptible to adversarial examples. These take the form of small perturbations applied to the model's input which lead to incorrect predictions. Unfortunately, most literature focuses on visually imperceivable perturbations to be applied to digital images that often are, by design, impossible to be deployed to physical targets. We present Adversarial Scratches: a novel L0 black-box attack, which takes the form of scratches in images, and which possesses much greater deployability than other state-of-the-art attacks. Adversarial Scratches leverage B\'ezier Curves to reduce the dimension of the search space and possibly constrain the attack to a specific location. We test Adversarial Scratches in several scenarios, including a publicly available API and images of traffic signs. Results show that, often, our attack achieves higher fooling rate than other deployable state-of-the-art methods, while requiring significantly fewer queries and modifying very few pixels.

It is often difficult to correctly infer a writer's emotion from text exchanged online, and differences in recognition between writers and readers can be problematic. In this paper, we propose a new framework for detecting sentences that create differences in emotion recognition between the writer and the reader and for detecting the kinds of expressions that cause such differences. The proposed framework consists of a bidirectional encoder representations from transformers (BERT)-based detector that detects sentences causing differences in emotion recognition and an analysis that acquires expressions that characteristically appear in such sentences. The detector, based on a Japanese SNS-document dataset with emotion labels annotated by both the writer and three readers of the social networking service (SNS) documents, detected "hidden-anger sentences" with AUC = 0.772; these sentences gave rise to differences in the recognition of anger. Because SNS documents contain many sentences whose meaning is extremely difficult to interpret, by analyzing the sentences detected by this detector, we obtained several expressions that appear characteristically in hidden-anger sentences. The detected sentences and expressions do not convey anger explicitly, and it is difficult to infer the writer's anger, but if the implicit anger is pointed out, it becomes possible to guess why the writer is angry. Put into practical use, this framework would likely have the ability to mitigate problems based on misunderstandings.

It is well-known that stochastic gradient noise (SGN) acts as implicit regularization for deep learning and is essentially important for both optimization and generalization of deep networks. Some works attempted to artificially simulate SGN by injecting random noise to improve deep learning. However, it turned out that the injected simple random noise cannot work as well as SGN, which is anisotropic and parameter-dependent. For simulating SGN at low computational costs and without changing the learning rate or batch size, we propose the Positive-Negative Momentum (PNM) approach that is a powerful alternative to conventional Momentum in classic optimizers. The introduced PNM method maintains two approximate independent momentum terms. Then, we can control the magnitude of SGN explicitly by adjusting the momentum difference. We theoretically prove the convergence guarantee and the generalization advantage of PNM over Stochastic Gradient Descent (SGD). By incorporating PNM into the two conventional optimizers, SGD with Momentum and Adam, our extensive experiments empirically verified the significant advantage of the PNM-based variants over the corresponding conventional Momentum-based optimizers.

With the rapid advancement and increased use of deep learning models in image identification, security becomes a major concern to their deployment in safety-critical systems. Since the accuracy and robustness of deep learning models are primarily attributed from the purity of the training samples, therefore the deep learning architectures are often susceptible to adversarial attacks. Adversarial attacks are often obtained by making subtle perturbations to normal images, which are mostly imperceptible to humans, but can seriously confuse the state-of-the-art machine learning models. We propose a framework, named APuDAE, leveraging Denoising AutoEncoders (DAEs) to purify these samples by using them in an adaptive way and thus improve the classification accuracy of the target classifier networks that have been attacked. We also show how using DAEs adaptively instead of using them directly, improves classification accuracy further and is more robust to the possibility of designing adaptive attacks to fool them. We demonstrate our results over MNIST, CIFAR-10, ImageNet dataset and show how our framework (APuDAE) provides comparable and in most cases better performance to the baseline methods in purifying adversaries. We also design adaptive attack specifically designed to attack our purifying model and demonstrate how our defense is robust to that.

Earth System Models (ESMs) are the primary tools for investigating future Earth system states at time scales from decades to centuries, especially in response to anthropogenic greenhouse gas release. State-of-the-art ESMs can reproduce the observational global mean temperature anomalies of the last 150 years. Nevertheless, ESMs need further improvements, most importantly regarding (i) the large spread in their estimates of climate sensitivity, i.e., the temperature response to increases in atmospheric greenhouse gases, (ii) the modeled spatial patterns of key variables such as temperature and precipitation, (iii) their representation of extreme weather events, and (iv) their representation of multistable Earth system components and their ability to predict associated abrupt transitions. Here, we argue that making ESMs automatically differentiable has huge potential to advance ESMs, especially with respect to these key shortcomings. First, automatic differentiability would allow objective calibration of ESMs, i.e., the selection of optimal values with respect to a cost function for a large number of free parameters, which are currently tuned mostly manually. Second, recent advances in Machine Learning (ML) and in the amount, accuracy, and resolution of observational data promise to be helpful with at least some of the above aspects because ML may be used to incorporate additional information from observations into ESMs. Automatic differentiability is an essential ingredient in the construction of such hybrid models, combining process-based ESMs with ML components. We document recent work showcasing the potential of automatic differentiation for a new generation of substantially improved, data-informed ESMs.

Time series forecasting is an important problem, with many real world applications. Ensembles of deep neural networks have recently achieved impressive forecasting accuracy, but such large ensembles are impractical in many real world settings. Transformer models been successfully applied to a diverse set of challenging problems. We propose a novel adaptation of the original Transformer architecture focusing on the task of time series forecasting, called Persistence Initialization. The model is initialized as a naive persistence model by using a multiplicative gating mechanism combined with a residual skip connection. We use a decoder Transformer with ReZero normalization and Rotary positional encodings, but the adaptation is applicable to any auto-regressive neural network model. We evaluate our proposed architecture on the challenging M4 dataset, achieving competitive performance compared to ensemble based methods. We also compare against existing recently proposed Transformer models for time series forecasting, showing superior performance on the M4 dataset. Extensive ablation studies show that Persistence Initialization leads to better performance and faster convergence. As the size of the model increases, only the models with our proposed adaptation gain in performance. We also perform an additional ablation study to determine the importance of the choice of normalization and positional encoding, and find both the use of Rotary encodings and ReZero normalization to be essential for good forecasting performance.

In this paper, we present a new neural architectural block for the vision domain, named Mixing Regionally and Locally (MRL), developed with the aim of effectively and efficiently mixing the provided input features. We bifurcate the input feature mixing task as mixing at a regional and local scale. To achieve an efficient mix, we exploit the domain-wide receptive field provided by self-attention for regional-scale mixing and convolutional kernels restricted to local scale for local-scale mixing. More specifically, our proposed method mixes regional features associated with local features within a defined region, followed by a local-scale features mix augmented by regional features. Experiments show that this hybridization of self-attention and convolution brings improved capacity, generalization (right inductive bias), and efficiency. Under similar network settings, MRL outperforms or is at par with its counterparts in classification, object detection, and segmentation tasks. We also show that our MRL-based network architecture achieves state-of-the-art performance for H&E histology datasets. We achieved DICE of 0.843, 0.855, and 0.892 for Kumar, CoNSep, and CPM-17 datasets, respectively, while highlighting the versatility offered by the MRL framework by incorporating layers like group convolutions to improve dataset-specific generalization.  ( 2 min )

The Frank-Wolfe method has become increasingly useful in statistical and machine learning applications, due to the structure-inducing properties of the iterates, and especially in settings where linear minimization over the feasible set is more computationally efficient than projection. In the setting of Empirical Risk Minimization -- one of the fundamental optimization problems in statistical and machine learning -- the computational effectiveness of Frank-Wolfe methods typically grows linearly in the number of data observations $n$. This is in stark contrast to the case for typical stochastic projection methods. In order to reduce this dependence on $n$, we look to second-order smoothness of typical smooth loss functions (least squares loss and logistic loss, for example) and we propose amending the Frank-Wolfe method with Taylor series-approximated gradients, including variants for both deterministic and stochastic settings. Compared with current state-of-the-art methods in the regime where the optimality tolerance $\varepsilon$ is sufficiently small, our methods are able to simultaneously reduce the dependence on large $n$ while obtaining optimal convergence rates of Frank-Wolfe methods, in both the convex and non-convex settings. We also propose a novel adaptive step-size approach for which we have computational guarantees. Last of all, we present computational experiments which show that our methods exhibit very significant speed-ups over existing methods on real-world datasets for both convex and non-convex binary classification problems.  ( 3 min )

Today, creators of data-hungry deep neural networks (DNNs) scour the Internet for training fodder, leaving users with little control over or knowledge of when their data is appropriated for model training. To empower users to counteract unwanted data use, we design, implement and evaluate a practical system that enables users to detect if their data was used to train an DNN model. We show how users can create special data points we call isotopes, which introduce "spurious features" into DNNs during training. With only query access to a trained model and no knowledge of the model training process, or control of the data labels, a user can apply statistical hypothesis testing to detect if a model has learned the spurious features associated with their isotopes by training on the user's data. This effectively turns DNNs' vulnerability to memorization and spurious correlations into a tool for data provenance. Our results confirm efficacy in multiple settings, detecting and distinguishing between hundreds of isotopes with high accuracy. We further show that our system works on public ML-as-a-service platforms and larger models such as ImageNet, can use physical objects instead of digital marks, and remains generally robust against several adaptive countermeasures.  ( 2 min )

Automated Machine Learning with ensembling (or AutoML with ensembling) seeks to automatically build ensembles of Deep Neural Networks (DNNs) to achieve qualitative predictions. Ensemble of DNNs are well known to avoid over-fitting but they are memory and time consuming approaches. Therefore, an ideal AutoML would produce in one single run time different ensembles regarding accuracy and inference speed. While previous works on AutoML focus to search for the best model to maximize its generalization ability, we rather propose a new AutoML to build a larger library of accurate and diverse individual models to then construct ensembles. First, our extensive benchmarks show asynchronous Hyperband is an efficient and robust way to build a large number of diverse models to combine them. Then, a new ensemble selection method based on a multi-objective greedy algorithm is proposed to generate accurate ensembles by controlling their computing cost. Finally, we propose a novel algorithm to optimize the inference of the DNNs ensemble in a GPU cluster based on allocation optimization. The produced AutoML with ensemble method shows robust results on two datasets using efficiently GPU clusters during both the training phase and the inference phase.  ( 3 min )

Large Transformer models achieved the state-of-the-art status for Natural Language Understanding tasks and are increasingly becoming the baseline model architecture for modeling source code. Transformers are usually pre-trained on large unsupervised corpora, learning token representations and transformations relevant to modeling generally available text, and are then fine-tuned on a particular downstream task of interest. While fine-tuning is a tried-and-true method for adapting a model to a new domain -- for example, question-answering on a given topic -- generalization remains an on-going challenge. In this paper, we explore and evaluate transformer model fine-tuning for personalization. In the context of generating unit tests for Java methods, we evaluate learning to personalize to a specific software project using several personalization techniques. We consider three key approaches: (i) custom fine-tuning, which allows all the model parameters to be tuned; (ii) lightweight fine-tuning, which freezes most of the model's parameters, allowing tuning of the token embeddings and softmax layer only or the final layer alone; (iii) prefix tuning, which keeps model parameters frozen, but optimizes a small project-specific prefix vector. Each of these techniques offers a trade-off in total compute cost and predictive performance, which we evaluate by code and task-specific metrics, training time, and total computational operations. We compare these fine-tuning strategies for code generation and discuss the potential generalization and cost benefits of each in various deployment scenarios.  ( 3 min )

As an alcoholic beverage, wine has remained prevalent for thousands of years, and the quality assessment of wines has been significant in wine production and trade. Scholars have proposed various deep learning and machine learning algorithms for wine quality prediction, such as Support vector machine (SVM), Random Forest (RF), K-nearest neighbors (KNN), Deep neural network (DNN), and Logistic regression (LR). However, these methods ignore the inner relationship between the physical and chemical properties of the wine, for example, the correlations between pH values, fixed acidity, citric acid, and so on. To fill the gap, this paper conducts the Pearson correlation analysis, PCA analysis, and Shapiro-Wilk test on those properties and incorporates 1D-CNN architecture to capture the correlations among neighboring features. In addition, it implemented dropout and batch normalization techniques to improve the robustness of the proposed model. Massive experiments have shown that our method can outperform baseline approaches in wine quality prediction. Moreover, ablation experiments also demonstrate the effectiveness of incorporating the 1-D CNN module, Dropout, and normalization techniques.  ( 2 min )

Exposure to bio-aerosols such as mold spores and pollen can lead to adverse health effects. There is a need for a portable and cost-effective device for long-term monitoring and quantification of various bio-aerosols. To address this need, we present a mobile and cost-effective label-free bio-aerosol sensor that takes holographic images of flowing particulate matter concentrated by a virtual impactor, which selectively slows down and guides particles larger than ~6 microns to fly through an imaging window. The flowing particles are illuminated by a pulsed laser diode, casting their inline holograms on a CMOS image sensor in a lens-free mobile imaging device. The illumination contains three short pulses with a negligible shift of the flowing particle within one pulse, and triplicate holograms of the same particle are recorded at a single frame before it exits the imaging field-of-view, revealing different perspectives of each particle. The particles within the virtual impactor are localized through a differential detection scheme, and a deep neural network classifies the aerosol type in a label-free manner, based on the acquired holographic images. We demonstrated the success of this mobile bio-aerosol detector with a virtual impactor using different types of pollen (i.e., bermuda, elm, oak, pine, sycamore, and wheat) and achieved a blind classification accuracy of 92.91%. This mobile and cost-effective device weighs ~700 g and can be used for label-free sensing and quantification of various bio-aerosols over extended periods since it is based on a cartridge-free virtual impactor that does not capture or immobilize particulate matter.  ( 3 min )

Ejection fraction (EF) is a key indicator of cardiac function, allowing identification of patients prone to heart dysfunctions such as heart failure. EF is estimated from cardiac ultrasound videos known as echocardiograms (echo) by manually tracing the left ventricle and estimating its volume on certain frames. These estimations exhibit high inter-observer variability due to the manual process and varying video quality. Such sources of inaccuracy and the need for rapid assessment necessitate reliable and explainable machine learning techniques. In this work, we introduce EchoGNN, a model based on graph neural networks (GNNs) to estimate EF from echo videos. Our model first infers a latent echo-graph from the frames of one or multiple echo cine series. It then estimates weights over nodes and edges of this graph, indicating the importance of individual frames that aid EF estimation. A GNN regressor uses this weighted graph to predict EF. We show, qualitatively and quantitatively, that the learned graph weights provide explainability through identification of critical frames for EF estimation, which can be used to determine when human intervention is required. On EchoNet-Dynamic public EF dataset, EchoGNN achieves EF prediction performance that is on par with state of the art and provides explainability, which is crucial given the high inter-observer variability inherent in this task.  ( 3 min )

Prediction of individuals' race and ethnicity plays an important role in studies of racial disparity. Bayesian Improved Surname Geocoding (BISG), which relies on detailed Census information, has emerged as a leading methodology for this prediction task. Unfortunately, BISG suffers from two data problems. First, the Census often contains zero counts for minority groups in the locations where members of those groups reside. Second, many surnames -- especially those of minorities -- are missing from the Census data. We introduce a fully Bayesian Improved Surname Geocoding (fBISG) methodology that accounts for Census measurement error by extending the naive Bayesian inference of the BISG methodology. We also use additional data on last, first, and middle names taken from the voter files of six Southern states where self-reported race is available. Our empirical validation shows that the fBISG methodology and name supplements significantly improve the accuracy of race imputation, especially for racial minorities.

Normalization methods such as batch [Ioffe and Szegedy, 2015], weight [Salimansand Kingma, 2016], instance [Ulyanov et al., 2016], and layer normalization [Baet al., 2016] have been widely used in modern machine learning. Here, we study the weight normalization (WN) method [Salimans and Kingma, 2016] and a variant called reparametrized projected gradient descent (rPGD) for overparametrized least-squares regression. WN and rPGD reparametrize the weights with a scale g and a unit vector w and thus the objective function becomes non-convex. We show that this non-convex formulation has beneficial regularization effects compared to gradient descent on the original objective. These methods adaptively regularize the weights and converge close to the minimum l2 norm solution, even for initializations far from zero. For certain stepsizes of g and w , we show that they can converge close to the minimum norm solution. This is different from the behavior of gradient descent, which converges to the minimum norm solution only when started at a point in the range space of the feature matrix, and is thus more sensitive to initialization.

The rich longitudinal individual level data available from electronic health records (EHRs) can be used to examine treatment effect heterogeneity. However, estimating treatment effects using EHR data poses several challenges, including time-varying confounding, repeated and temporally non-aligned measurements of covariates, treatment assignments and outcomes, and loss-to-follow-up due to dropout. Here, we develop the Subgroup Discovery for Longitudinal Data (SDLD) algorithm, a tree-based algorithm for discovering subgroups with heterogeneous treatment effects using longitudinal data by combining the generalized interaction tree algorithm, a general data-driven method for subgroup discovery, with longitudinal targeted maximum likelihood estimation. We apply the algorithm to EHR data to discover subgroups of people living with human immunodeficiency virus (HIV) who are at higher risk of weight gain when receiving dolutegravir-containing antiretroviral therapies (ARTs) versus when receiving non dolutegravir-containing ARTs.

In industrial applications, nearly half the failures of motors are caused by the degradation of rolling element bearings (REBs). Therefore, accurately estimating the remaining useful life (RUL) for REBs are of crucial importance to ensure the reliability and safety of mechanical systems. To tackle this challenge, model-based approaches are often limited by the complexity of mathematical modeling. Conventional data-driven approaches, on the other hand, require massive efforts to extract the degradation features and construct health index. In this paper, a novel online data-driven framework is proposed to exploit the adoption of deep convolutional neural networks (CNN) in predicting the RUL of bearings. More concretely, the raw vibrations of training bearings are first processed using the Hilbert-Huang transform (HHT) and a novel nonlinear degradation indicator is constructed as the label for learning. The CNN is then employed to identify the hidden pattern between the extracted degradation indicator and the vibration of training bearings, which makes it possible to estimate the degradation of the test bearings automatically. Finally, testing bearings' RULs are predicted by using a $\epsilon$-support vector regression model. The superior performance of the proposed RUL estimation framework, compared with the state-of-the-art approaches, is demonstrated through the experimental results. The generality of the proposed CNN model is also validated by transferring to bearings undergoing different operating conditions.

Weak supervision (WS) is a powerful method to build labeled datasets for training supervised models in the face of little-to-no labeled data. It replaces hand-labeling data with aggregating multiple noisy-but-cheap label estimates expressed by labeling functions (LFs). While it has been used successfully in many domains, weak supervision's application scope is limited by the difficulty of constructing labeling functions for domains with complex or high-dimensional features. To address this, a handful of methods have proposed automating the LF design process using a small set of ground truth labels. In this work, we introduce AutoWS-Bench-101: a framework for evaluating automated WS (AutoWS) techniques in challenging WS settings -- a set of diverse application domains on which it has been previously difficult or impossible to apply traditional WS techniques. While AutoWS is a promising direction toward expanding the application-scope of WS, the emergence of powerful methods such as zero-shot foundation models reveals the need to understand how AutoWS techniques compare or cooperate with modern zero-shot or few-shot learners. This informs the central question of AutoWS-Bench-101: given an initial set of 100 labels for each task, we ask whether a practitioner should use an AutoWS method to generate additional labels or use some simpler baseline, such as zero-shot predictions from a foundation model or supervised learning. We observe that in many settings, it is necessary for AutoWS methods to incorporate signal from foundation models if they are to outperform simple few-shot baselines, and AutoWS-Bench-101 promotes future research in this direction. We conclude with a thorough ablation study of AutoWS methods.

Standardized datasets and benchmarks have spurred innovations in computer vision, natural language processing, multi-modal and tabular settings. We note that, as compared to other well researched fields fraud detection has numerous differences. The differences include a high class imbalance, diverse feature types, frequently changing fraud patterns, and adversarial nature of the problem. Due to these differences, the modeling approaches that are designed for other classification tasks may not work well for the fraud detection. We introduce Fraud Dataset Benchmark (FDB), a compilation of publicly available datasets catered to fraud detection. FDB comprises variety of fraud related tasks, ranging from identifying fraudulent card-not-present transactions, detecting bot attacks, classifying malicious URLs, predicting risk of loan to content moderation. The Python based library from FDB provides consistent API for data loading with standardized training and testing splits. For reference, we also provide baseline evaluations of different modeling approaches on FDB. Considering the increasing popularity of Automated Machine Learning (AutoML) for various research and business problems, we used AutoML frameworks for our baseline evaluations. For fraud prevention, the organizations that operate with limited resources and lack ML expertise often hire a team of investigators, use blocklists and manual rules, all of which are inefficient and do not scale well. Such organizations can benefit from AutoML solutions that are easy to deploy in production and pass the bar of fraud prevention requirements. We hope that FDB helps in the development of customized fraud detection techniques catered to different fraud modus operandi (MOs) as well as in the improvement of AutoML systems that can work well for all datasets in the benchmark.

In recent studies, the generalization properties for distributed learning and random features assumed the existence of the target concept over the hypothesis space. However, this strict condition is not applicable to the more common non-attainable case. In this paper, using refined proof techniques, we first extend the optimal rates for distributed learning with random features to the non-attainable case. Then, we reduce the number of required random features via data-dependent generating strategy, and improve the allowed number of partitions with additional unlabeled data. Theoretical analysis shows these techniques remarkably reduce computational cost while preserving the optimal generalization accuracy under standard assumptions. Finally, we conduct several experiments on both simulated and real-world datasets, and the empirical results validate our theoretical findings.

Missing data is a commonly occurring problem in practice. Many imputation methods have been developed to fill in the missing entries. However, not all of them can scale to high-dimensional data, especially the multiple imputation techniques. Meanwhile, the data nowadays tends toward high-dimensional. Therefore, in this work, we propose Principal Component Analysis Imputation (PCAI), a simple but versatile framework based on Principal Component Analysis (PCA) to speed up the imputation process and alleviate memory issues of many available imputation techniques, without sacrificing the imputation quality in term of MSE. In addition, the frameworks can be used even when some or all of the missing features are categorical, or when the number of missing features is large. Next, we introduce PCA Imputation - Classification (PIC), an application of PCAI for classification problems with some adjustments. We validate our approach by experiments on various scenarios, which shows that PCAI and PIC can work with various imputation algorithms, including the state-of-the-art ones and improve the imputation speed significantly, while achieving competitive mean square error/classification accuracy compared to direct imputation (i.e., impute directly on the missing data).

The Frank-Wolfe method has become increasingly useful in statistical and machine learning applications, due to the structure-inducing properties of the iterates, and especially in settings where linear minimization over the feasible set is more computationally efficient than projection. In the setting of Empirical Risk Minimization -- one of the fundamental optimization problems in statistical and machine learning -- the computational effectiveness of Frank-Wolfe methods typically grows linearly in the number of data observations $n$. This is in stark contrast to the case for typical stochastic projection methods. In order to reduce this dependence on $n$, we look to second-order smoothness of typical smooth loss functions (least squares loss and logistic loss, for example) and we propose amending the Frank-Wolfe method with Taylor series-approximated gradients, including variants for both deterministic and stochastic settings. Compared with current state-of-the-art methods in the regime where the optimality tolerance $\varepsilon$ is sufficiently small, our methods are able to simultaneously reduce the dependence on large $n$ while obtaining optimal convergence rates of Frank-Wolfe methods, in both the convex and non-convex settings. We also propose a novel adaptive step-size approach for which we have computational guarantees. Last of all, we present computational experiments which show that our methods exhibit very significant speed-ups over existing methods on real-world datasets for both convex and non-convex binary classification problems.

Advanced optimization algorithms such as Newton method and AdaGrad benefit from second order derivative or second order statistics to achieve better descent directions and faster convergence rates. At their heart, such algorithms need to compute the inverse or inverse square root of a matrix whose size is quadratic of the dimensionality of the search space. For high dimensional search spaces, the matrix inversion or inversion of square root becomes overwhelming which in turn demands for approximate methods. In this work, we propose a new matrix approximation method which divides a matrix into blocks and represents each block by one or two numbers. The method allows efficient computation of matrix inverse and inverse square root. We apply our method to AdaGrad in training deep neural networks. Experiments show encouraging results compared to the diagonal approximation.

This paper attempts to establish the theoretical foundation for the emerging super-model paradigm via domain adaptation, where one first trains a very large-scale model, {\it i.e.}, super model (or foundation model in some other papers), on a large amount of data and then adapts it to various specific domains. Super-model paradigms help reduce computational and data cost and carbon emission, which is critical to AI industry, especially enormous small and medium-sized enterprises. We model the super-model paradigm as a two-stage diffusion process: (1) in the pre-training stage, the model parameter diffuses from random initials and converges to a steady distribution; and (2) in the fine-tuning stage, the model parameter is transported to another steady distribution. Both training stages can be mathematically modeled by the Uhlenbeck-Ornstein process which converges to two Maxwell-Boltzmann distributions, respectively, each of which characterizes the corresponding convergent model. An $\mathcal O(1/\sqrt{N})$ generalization bound is then established via PAC-Bayesian framework. The theory finds that the generalization error of the fine-tuning stage is dominant in domain adaptation. In addition, our theory suggests that the generalization is determined by a new measure that characterizes the domain discrepancy between the source domain and target domain, based on the covariance matrices and the shift of the converged local minimum.

We study the convergence of divergence-regularized optimal transport as the regularization parameter vanishes. Sharp rates for general divergences including relative entropy or $L^{p}$ regularization, general transport costs and multi-marginal problems are obtained. A novel methodology using quantization and martingale couplings is suitable for non-compact marginals and achieves, in particular, the sharp leading-order term of entropically regularized 2-Wasserstein distance for all marginals with finite $(2+\delta)$-moment.

Structural health monitoring (SHM) has been an active research area for the last three decades, and has accumulated a number of critical advances over that period, as can be seen in the literature. However, SHM is still facing challenges because of the paucity of damage-state data, operational and environmental fluctuations, repeatability issues, and changes in boundary conditions. These issues present as inconsistencies in the captured features and can have a huge impact on the practical implementation, but more critically, on the generalisation of the technology. Population-based SHM has been designed to address some of these concerns by modelling and transferring missing information using data collected from groups of similar structures. In this work, vibration data were collected from four healthy, nominally-identical, full-scale composite helicopter blades. Manufacturing differences (e.g., slight differences in geometry and/or material properties), among the blades presented as variability in their structural dynamics, which can be very problematic for SHM based on machine learning from vibration data. This work aims to address this variability by defining a general model for the frequency response functions of the blades, called a form, using mixtures of Gaussian processes.

Causal representation learning exposes latent high-level causal variables behind low-level observations, which has enormous potential for a set of downstream tasks of interest. Despite this, identifying the true latent causal representation from observed data is a great challenge. In this work we focus on identifying latent causal variables. To this end, we analysis three intrinsic properties in latent space, including transitivity, permutation and scaling. We show that the transitivity severely hinders the identifiability of latent causal variables, while permutation and scaling guide the direction of identifying latent causal variable. To break the transitivity, we assume the underlying latent causal relations to be linear Gaussian models, in which the weights, mean and variance of Gaussian noise are modulated by an additionally observed variable. Under these assumptions we theoretically show that the latent causal variables can be identifiable up to trivial permutation and scaling. Built on this theoretical result, we propose a novel method, termed Structural caUsAl Variational autoEncoder, which directly learns latent causal variables, together with the mapping from the latent causal variables to the observed ones. Experimental results on synthetic and real data demonstrate the identifiable result and the ability of the proposed method for learning latent causal variables.

Active regression considers a linear regression problem where the learner receives a large number of data points but can only observe a small number of labels. Since online algorithms can deal with incremental training data and take advantage of low computational cost, we consider an online extension of the active regression problem: the learner receives data points one by one and immediately decides whether it should collect the corresponding labels. The goal is to efficiently maintain the regression of received data points with a small budget of label queries. We propose novel algorithms for this problem under $\ell_p$ loss where $p\in[1,2]$. To achieve a $(1+\epsilon)$-approximate solution, our proposed algorithms only require $\tilde{\mathcal{O}}(\epsilon^{-1} d \log(n\kappa))$ queries of labels, where $n$ is the number of data points and $\kappa$ is a quantity, called the condition number, of the data points. The numerical results verify our theoretical results and show that our methods have comparable performance with offline active regression algorithms.

We consider the offline reinforcement learning problem, where the aim is to learn a decision making policy from logged data. Offline RL -- particularly when coupled with (value) function approximation to allow for generalization in large or continuous state spaces -- is becoming increasingly relevant in practice, because it avoids costly and time-consuming online data collection and is well suited to safety-critical domains. Existing sample complexity guarantees for offline value function approximation methods typically require both (1) distributional assumptions (i.e., good coverage) and (2) representational assumptions (i.e., ability to represent some or all $Q$-value functions) stronger than what is required for supervised learning. However, the necessity of these conditions and the fundamental limits of offline RL are not well understood in spite of decades of research. This led Chen and Jiang (2019) to conjecture that concentrability (the most standard notion of coverage) and realizability (the weakest representation condition) alone are not sufficient for sample-efficient offline RL. We resolve this conjecture in the positive by proving that in general, even if both concentrability and realizability are satisfied, any algorithm requires sample complexity polynomial in the size of the state space to learn a non-trivial policy. Our results show that sample-efficient offline reinforcement learning requires either restrictive coverage conditions or representation conditions that go beyond supervised learning, and highlight a phenomenon called over-coverage which serves as a fundamental barrier for offline value function approximation methods. A consequence of our results for reinforcement learning with linear function approximation is that the separation between online and offline RL can be arbitrarily large, even in constant dimension.

Multi-source domain adaptation (MSDA) learns to predict the labels in target domain data, under the setting where all data from multiple source domains are labelled and the data from the target domain are unlabeled. To handle this problem, most of methods focus on learning invariant representations across domains. However, their success severely relies on the assumption that label distribution remains unchanged across domains. To mitigate it, we propose a new assumption, latent covariate shift, where the marginal distribution of the latent content variable changes across domains, and the conditional distribution of the label given the latent content remains invariant across domains. We introduce a latent style variable to complement the latent content variable forming a latent causal graph as the data and label generating process. We show that although the latent style variable is unidentifiable due to transitivity property in the latent space, the latent content variable can be identified up to simple scaling under some mild conditions. This motivates us to propose a novel method for MSDA, which learns the invariant label distribution conditional on the latent content variable, instead of learning invariant representations. Empirical evaluation on simulation and real data demonstrates the effectiveness of the proposed method, compared with many state-of-the-art methods based on invariant representation.

The manufacturing sector is envisioned to be heavily influenced by artificial intelligence-based technologies with the extraordinary increases in computational power and data volumes. A central challenge in manufacturing sector lies in the requirement of a general framework to ensure satisfied diagnosis and monitoring performances in different manufacturing applications. Here we propose a general data-driven, end-to-end framework for the monitoring of manufacturing systems. This framework, derived from deep learning techniques, evaluates fused sensory measurements to detect and even predict faults and wearing conditions. This work exploits the predictive power of deep learning to automatically extract hidden degradation features from noisy, time-course data. We have experimented the proposed framework on ten representative datasets drawn from a wide variety of manufacturing applications. Results reveal that the framework performs well in examined benchmark applications and can be applied in diverse contexts, indicating its potential use as a critical corner stone in smart manufacturing.

We propose a dynamic network sampling scheme to optimize block recovery for stochastic blockmodel (SBM) in the case where it is prohibitively expensive to observe the entire graph. Theoretically, we provide justification of our proposed Chernoff-optimal dynamic sampling scheme via the Chernoff information. Practically, we evaluate the performance, in terms of block recovery, of our method on several real datasets from different domains. Both theoretically and practically results suggest that our method can identify vertices that have the most impact on block structure so that one can only check whether there are edges between them to save significant resources but still recover the block structure.

One of the most fundamental problems in machine learning is to compare examples: Given a pair of objects we want to return a value which indicates degree of (dis)similarity. Similarity is often task specific, and pre-defined distances can perform poorly, leading to work in metric learning. However, being able to learn a similarity-sensitive distance function also presupposes access to a rich, discriminative representation for the objects at hand. In this dissertation we present contributions towards both ends. In the first part of the thesis, assuming good representations for the data, we present a formulation for metric learning that makes a more direct attempt to optimize for the k-NN accuracy as compared to prior work. We also present extensions of this formulation to metric learning for kNN regression, asymmetric similarity learning and discriminative learning of Hamming distance. In the second part, we consider a situation where we are on a limited computational budget i.e. optimizing over a space of possible metrics would be infeasible, but access to a label aware distance metric is still desirable. We present a simple, and computationally inexpensive approach for estimating a well motivated metric that relies only on gradient estimates, discussing theoretical and experimental results. In the final part, we address representational issues, considering group equivariant convolutional neural networks (GCNNs). Equivariance to symmetry transformations is explicitly encoded in GCNNs; a classical CNN being the simplest example. In particular, we present a SO(3)-equivariant neural network architecture for spherical data, that operates entirely in Fourier space, while also providing a formalism for the design of fully Fourier neural networks that are equivariant to the action of any continuous compact group.

We prove that natural gradient descent, with respect to the parameters of a machine learning policy, admits a conjugate dynamical description consistent with evolution by natural selection. We characterize these conjugate dynamics as a locally optimal fit to the continuous-time replicator dynamics, and show that the Price equation applies to equivalence classes of functions belonging to a Hilbert space generated by the policy's architecture and parameters. We posit that "conjugate natural selection" intuitively explains the empirical effectiveness of natural gradient descent, while developing a useful analytic approach to the dynamics of machine learning.

Moment methods are an important means of density estimation, but they are generally strongly dependent on the choice of feasible functions, which severely affects the performance. We propose a non-classical parameterization for density estimation using the sample moments, which does not require the choice of such functions. The parameterization is induced by the Kullback-Leibler distance, and the solution of it, which is proved to exist and be unique subject to simple prior that does not depend on data, can be obtained by convex optimization. Simulation results show the performance of the proposed estimator in estimating multi-modal densities which are mixtures of different types of functions.

Adversarial training instances can severely distort a model's behavior. This work investigates certified regression defenses, which provide guaranteed limits on how much a regressor's prediction may change under a training-set attack. Our key insight is that certified regression reduces to certified classification when using median as a model's primary decision function. Coupling our reduction with existing certified classifiers, we propose six new provably-robust regressors. To the extent of our knowledge, this is the first work that certifies the robustness of individual regression predictions without any assumptions about the data distribution and model architecture. We also show that existing state-of-the-art certified classifiers often make overly-pessimistic assumptions that can degrade their provable guarantees. We introduce a tighter analysis of model robustness, which in many cases results in significantly improved certified guarantees. Lastly, we empirically demonstrate our approaches' effectiveness on both regression and classification data, where the accuracy of up to 50% of test predictions can be guaranteed under 1% training-set corruption and up to 30% of predictions under 4% corruption. Our source code is available at https://github.com/ZaydH/certified-regression.

While (message-passing) graph neural networks have clear limitations in approximating permutation-equivariant functions over graphs or general relational data, more expressive, higher-order graph neural networks do not scale to large graphs. They either operate on $k$-order tensors or consider all $k$-node subgraphs, implying an exponential dependence on $k$ in memory requirements, and do not adapt to the sparsity of the graph. By introducing new heuristics for the graph isomorphism problem, we devise a class of universal, permutation-equivariant graph networks, which, unlike previous architectures, offer a fine-grained control between expressivity and scalability and adapt to the sparsity of the graph. These architectures lead to vastly reduced computation times compared to standard higher-order graph networks in the supervised node- and graph-level classification and regression regime while significantly improving over standard graph neural network and graph kernel architectures in terms of predictive performance.

While sample efficiency is the main motive for use of Bayesian optimisation when black-box functions are expensive to evaluate, the standard approach based on type II maximum likelihood (ML-II) may fail and result in disappointing performance in small-sample trials. The paper provides three compelling reasons to adopt fully Bayesian optimisation (FBO) as an alternative. First, failures of ML-II are more commonplace than implied by the existing studies using the contrived settings. Second, FBO is more robust than ML-II, and the price of robustness is almost trivial. Third, FBO has become simple to implement and fast enough to be practical. The paper supports the argument using relevant experiments, which reflect the current practice regarding models, algorithms, and software platforms. Since the benefits seem to outweigh the costs, researchers should consider adopting FBO for their applications so that they can guard against potential failures that end up wasting precious research resources.

Diffusion models are a class of generative models, showing superior performance as compared to other generative models in creating realistic images when trained on natural image datasets. We introduce DISPR, a diffusion-based model for solving the inverse problem of three-dimensional (3D) cell shape prediction from two-dimensional (2D) single cell microscopy images. Using the 2D microscopy image as a prior, DISPR is conditioned to predict realistic 3D shape reconstructions. To showcase the applicability of DISPR as a data augmentation tool in a feature-based single cell classification task, we extract morphological features from the cells grouped into six highly imbalanced classes. Adding features from predictions of DISPR to the three minority classes improved the macro F1 score from $F1_\text{macro} = 55.2 \pm 4.6\%$ to $F1_\text{macro} = 72.2 \pm 4.9\%$. With our method being the first to employ a diffusion-based model in this context, we demonstrate that diffusion models can be applied to inverse problems in 3D, and that they learn to reconstruct 3D shapes with realistic morphological features from 2D microscopy images.

Bilinear dynamical systems are ubiquitous in many different domains and they can also be used to approximate more general control-affine systems. This motivates the problem of learning bilinear systems from a single trajectory of the system's states and inputs. Under a mild marginal mean-square stability assumption, we identify how much data is needed to estimate the unknown bilinear system up to a desired accuracy with high probability. Our sample complexity and statistical error rates are optimal in terms of the trajectory length, the dimensionality of the system and the input size. Our proof technique relies on an application of martingale small-ball condition. This enables us to correctly capture the properties of the problem, specifically our error rates do not deteriorate with increasing instability. Finally, we show that numerical experiments are well-aligned with our theoretical results.

About Equinox blends in the ease of PyTorch-like API with the functionality of JAX. Eqxvision is intended to be an extension to Equinox catered for computer vision research. Github, Documentation With Eqxvision, the idea is to support torchvision like API for various computer vision models. As a one stop solution, this cuts down the need to look for an ideal (and working) github implementation of your favourite network. It started off as a hobby project for me to get familiar with JAX and having an existing understanding of PyTorch, Equinox served as an excellent starting point. Usage As simple as model = eqxvision.models.resnet50(pretrained=True) Replace resnet50 with your favourite classification model. At the moment, the library supports almost all of the image classification models along with their pre-trained weights ported from torchvision. Checkout Torchvision vs. Eqxvision ImageNet-1k accuracy comparison here. What's Next? I plan to expand by introducing CV models from the domains of segmentation, object detection ... Introducing some advanced tutorials to cover API usage and different problems in computer vision. Some basic tutorials are listed here. Acknowledgements Working on Eqxvision and Equinox, I got the chance to learn a lot from u/patrickkidger. Thanks! Also, a shout-out to torchvision and timm, for doing much of the heavy lifting. submitted by /u/PaganPasta [link] [comments]  ( 90 min )

Hi, I am reading the concept of collaborative learning, and I came to know that it is also called federated learning, but the following link performs averaging: federated learning or collaborative learning When locally trained, the updated models are sent back to the central server via encrypted communication channels. Well, here it’s worth noting that the server doesn’t get any real data, but only trained parameters of the model (e.g., weights in neural networks). The updates from all clients are averaged and aggregated into a single shared model, improving its accuracy. But the following text uses pruning, The training method implicit in the framework could be described as a semi-supervised and halfway model pruning collaborative learning method, denoted by SSHFMP. I got the above text from the following paper: Following is the link of the paper (NetSpirit: A Smart Collaborative Learning Framework for DDoS Attack Detection): NetSprint Both the paper and web article focus on collaborative learning. Somebody, please guide me on why the link https://www.altexsoft.com/blog/federated-learning/ uses the concept of averaging and why the research paper uses the concept of pruning. Zulfi. submitted by /u/Snoo20972 [link] [comments]  ( 89 min )

Hi, I have a problem in understanding the problem of collaborative learning as discussed in the following text: Fine-grained pruning usually refers to weight pruning, which forces a portion of each layer’s weights to zero according to the L1 or L2 norm, without affecting the structure of the model. In collaborative learning, before the server sends the parameters to the participant, a certain compression algorithm (e.g., gzip) will be applied to the pruned weights. The higher the pruning ratio, the more zeros are set, and the smaller the size of the compressed parameters. Following is the link of the paper (NetSpirit: A Smart Collaborative Learning Framework for DDoS Attack Detection): http://www.thucsnet.com/wp-content/papers/ke_network2021.pdf Somebody, please guide me. Zulfi. submitted by /u/Snoo20972 [link] [comments]  ( 90 min )

Throwaway because reasons. I always thought of myself as a researcher kind of person. However, not having a CS background (but a very recent PhD with a "new" ML method nonetheless) and being from Europe , I do not have a track record of publication. It is actually rather puny tbh. Recently, a recruiter from Meta reached out to offer me a role as an ML engineer. I was happy at first, but a little disappointed now, since it is not research. On the other hand, working for Meta could help me improve my publication record I guess, but I am not at all sure what to do. What would you do? tldr; I wanted to be a researcher with almost no publications, but Meta offered me a role as ML Engineer. What to do? ​ View Poll submitted by /u/burn-with-fire [link] [comments]  ( 91 min )

Hello, I am doing research on flight trajectory planning. I am currently gathering research papers but I want to post this discussion if anyone has insights on previous works (code preferable but not necessary). submitted by /u/Environmental-Fee753 [link] [comments]  ( 88 min )

AutoML discussion Hi everyone Recently I came across AutoML platforms/tools (e.g. PyCaret, H2OAutoML), I was blown-away by the amount of such tools that I wondered what the community thinks about them. When would one use a tool like that? Is there any tools that are considered "standard" for someone to know? I would really like to know people's expirence with it and thoughts about it. submitted by /u/SpiritofPleasure [link] [comments]  ( 91 min )

Last night I watched movie "Snowden" and I got inspiration from that movie. I thought about making project where I will make program that scrapes web and saves data. That data should tell me about local news/gossips in my local area, but thats after AI "comb through" all that data. This is my first AI project and I am very interested in AI last few months. What software should I use? What programming language? Litereally I dont know how to start. I realized that, in order to do this, I need know: To make web scraper How to store all this data (databases) To implement AI (this is most unknown to me so if you have any advices, be free to write) Would you add something? I know that programs from movie Snowden were based on real events and I knoe that it was made by hundreds of people, so thats why I am trying to make it for my local area. Even if I dont succeed, it is precious experience that I'll gain going through this project. submitted by /u/wannacry011 [link] [comments]  ( 90 min )

Hi guys, I'm working on a time-series problem (with ~240 datapoints) and every LSTM I train keeps predicting the same value for different inputs. I tried every suggested solution on stackoverflow and similar pages (changing activation functions, dropout, lag, layers, amount of nodes, different lags) but it still keeps predicting the same value (with a few models I got a repetitive pattern that was predicted with three different values). The last possibility I read is, that I have to few data, which makes sense. Still, wanted to check what you guys think - thanks in advance. submitted by /u/PrinceDome [link] [comments]  ( 90 min )

Happy to share that our study on designing DNA sequences to control gene expression using generative deep learning is just out! https://www.nature.com/articles/s41467-022-32818-8 This is a continuation of our previous work, where we learned to 'read' regulatory DNA using deep neural nets, accurately predicting gene expression levels in multiple organisms and finding predictive regulatory grammar across whole gene regulatory regions. https://www.nature.com/articles/s41467-020-19921-4 Here we combine the predictive models with advanced generative models in an architecture termed ExpressionGAN that can be used to 'write' (design) de novo regulatory DNA with target gene expression levels. submitted by /u/janimezzz [link] [comments]  ( 108 min )

As we know, the 2>1 MLP cannot model the XOR operation, which is (I've been told) the reason why multi-layer MLP's/NN's were created as single-layer MLP's cannot model everything. It is fair to see that, given a set of data points, the single layer MLP when trained on a problem like XOR is very sensitive to initial conditions and those initial conditions will dictate what sort of "XOR" MLP we're going to get. ​ So I've setup an experiment, I vary the initial conditions and fix the bias of a single-layer MLP then train it on a small set of randomly generated data using Gradient Descent with eta=0.1 to see what error are we going to get out of it; i.e: Which XOR test will fail. I obtained this small animation: Results https://reddit.com/link/x1k0nm/video/gx8k1cctcvk91/player The failures I've defined are as such: Symmetric OR Test: 1 XOR 0 != 0 XOR 1 Xclusive Test: 1 XOR 1 = 1 Negative OR Test: 0 XOR 0 = 1 Note: More than 1 Failure includes failing 1 XOR 0 = 1 and 0 XOR 1 = 1 I have four observations/questions: Why is it not failing the Negative OR Test What's causing the discontinuity at 0.5 Why is the result not symmetric with respect to the bias, It should be... If I multiply the weights by -1 I should get the same result I assume Why does it appear "fractal" What's happening in the negative-negative region, this could be modeled further; Though the data takes a bit long to get (Taken me over an hour and 15 minutes on a powerful CPU while running in parallel on 4 cores in Julia submitted by /u/qfl3x [link] [comments]  ( 109 min )

Hi, I'm inquisitive about this, I've read some applied fields like biology papers, and they seldom used ensemble models as a baseline or primary model. Still, these models are proven to have excellent performance in competitions, why? submitted by /u/PaintTop5512 [link] [comments]  ( 95 min )

​ My Implementation of Pix2Seq in PyTorch | Image By Me Object Detection with Transformers and Language Modeling! I've implemented Pix2Seq paper and written an in-depth tutorial on it. Link to my Towards AI blog Link to the project on my GitHub. Link to the Colab Notebook submitted by /u/moein-shariatnia [link] [comments]  ( 88 min )

Below is an excerpt from a paper titled "Representation Learning for Information Extraction from Form-like Documents" : "As shown in Figure 2, we represent the position of a candidate and each of its neighbors using the 2-D Cartesian coordinates of the centroids of their respective bounding boxes. These coordinates are normalized by dividing by the corresponding page dimensions so that the features are independent of the pixel resolution of the input documents." Below is an image which they have referred to : ​ ​ https://preview.redd.it/vzkh11h25uk91.png?width=1182&format=png&auto=webp&s=de776e50c89c8699f115ed36c8c4931d4d27569f I am trying to wrap my head around how normalizing helps in making the feature independent of pixel resolution of the input document. Can someone help explain this. #documentintelligence submitted by /u/fountainhop [link] [comments]  ( 89 min )

I'm trying to fuse two embeddings (from pretrained models) of different dimensions, 1024 and 2048. What's the right way of going about this? Would it be okay for instance, to pass the 2048-dimensional embedding through a Linear layer with output size 1024, and then proceed with standard fusion strategies? Or is there a better way? submitted by /u/fullgoopy_alchemist [link] [comments]  ( 89 min )

I'm finding myself spending what feels like a stupid amount of time cleaning up the Bibtex entries I get from arxiv/dblp/whatever so that the citations actually look how I want when references get generated. This includes removing extraneous fields, cleaning up conference names, force-capitalizing words like Bayesian, etc. But the thing that pains me more is I know there are thousands of other people out there wasting thousands of hours doing exactly the same thing, to get the citations to look essentially the same. Is there a tool for doing this automatically? I'm thinking something like MathpixSnip but for bibtex entries specifically, but something hard-coded could maybe work too? Or some other hacky way of going about this? Any input would be much appreciated! :-) submitted by /u/_-__-____ [link] [comments]  ( 89 min )

I was just amazed at how realistic Tesla's simulation was during its "Tesla AI Day". Here's the clip I'm talking about: https://www.youtube.com/watch?v=-gBha9l-ZiA Anyone know what kind of neural rendering techniques could have been used? I feel like it can't be style transfer since there'll be some weird temporal artifacts as shown in this Two Minute Papers 3D style transfer video: https://www.youtube.com/watch?v=fcnjHmBcLNQ Also specifically how do you think they made the color distribution of the simulation match exactly the real images? submitted by /u/Snoo_1043 [link] [comments]  ( 91 min )

Hi. I'm currently trying to deal with text data that contains more than one language. I've resorted to using a multilingual language model in order to properly encode the sequence, but I'm wondering if this is the only way to go about it. I've thought of using multiple models to encode the sequence in each language (assuming they're using the same tokenization algorithm) and combining their representations to minimize the proportion of unknown tokens, but am not exactly sure if this is a viable or efficient approach. Are there any other ways that I haven't thought of? Any tips or pointers are appreciated, thanks! submitted by /u/Seankala [link] [comments]  ( 90 min )

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There are a lot of text-to-image AIs now, but I am wondering if there is any AIs that take a image and text as an input. I.E? Let's say you take a picture of yourself. You input that image, and then you also write "Holding a banana" and it would essentially photoshop a banana in your hand. Is this a thing yet? submitted by /u/ResearchFew9041 [link] [comments]  ( 87 min )

Hi. I have a strange question, a request. Is there an artificial intelligence site where I can generate daily events that can happen to a person throughout his life? It doesn't matter if it's paid or free. I don't know if there is an artificial intelligence that can do this, but I wanted to ask anyway. ​ I'm talking about any event in daily life. For example, the character may splash water on him while walking, his dog may die, his lover may cheat, or he may spill his food on him. So there is no limit. I want any daily event. ​ Maybe it would be even better if I could categorize it. For example, can I write what will happen to a cook? ​ Waiting for your ideas. Sorry for my bad English. submitted by /u/yungfrxzn [link] [comments]  ( 88 min )

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Any knowledge graphs resouces links !? And also curious to know its real world applications. Im aspiring to startup narrowing to KG submitted by /u/rexstiener [link] [comments]  ( 91 min )

Any knowledge graphs resources!? And its applications in real world. submitted by /u/rexstiener [link] [comments]  ( 86 min )

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OK, this is a trivial request but I actually find the crazy responses you get from AI text production to be hilarious. As an example, this video from Kyle Hill had me laughing my ass off: https://www.youtube.com/watch?v=cKfnjxMS2RM   So can anyone recommend a free website that uses AI that can churn out nonsense like this? It's almost better if it isn't actually very good at sounding human. I just want something that can give me a laugh when I give it a little bit of text to work off.   Thanks in advance to anyone who can help me. submitted by /u/ClerkMark [link] [comments]  ( 87 min )

Are there any AI that can help organize and manage files? I don't have idea how it will work though. Because file organization is subjective. But sometimes I think all these cluttered files. That I think will be useful but never find them except by accident later. Maybe at least a local search engine. The amount of data we have locally is now huge going to many terabytes. However the search system is very primitive. submitted by /u/Mister-Khalifa [link] [comments]  ( 87 min )

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I am a classroom teacher. I would LOVE an app where my students could enter a math problem (or take a photo of it) and out comes a generated step-by-step explainer video. Think of Khan Academy style explainer videos for the exact problem that you’re trying to solve. Does anyone know if this exists? Thanks! submitted by /u/elliottzelinskas [link] [comments]  ( 87 min )

The PyTorch team recently released a Deep Learning Compiler for NVIDIA GPUs called nvFuser. This compiler automatically creates quick, adaptable kernels, speeding up user networks. Creating quick bespoke “fusion” kernels at runtime also significantly accelerates deep learning networks running on Volta and later CUDA accelerators. The new and updated compiler, nvFuser, supports a variety of network architectures as well as applications with dynamic inputs of different shapes and strides and has been specially created to address the particular needs of the PyTorch community. In order to optimize and accelerate PyTorch operations, nvFuser uses graphical representations. Users’ PyTorch operations are not directly accessible as a complete program that a system like nvFuser can optimize because PyTorch uses an eager execution approach. As a result, there is a need for intermediary systems that can translate user programs into a format that nvFuser can optimize. These more advanced methods send the captured operations to nvFuser, which can subsequently tailor the user’s script execution for NVIDIA GPUs. Continue reading |Github link | Reference article submitted by /u/ai-lover [link] [comments]  ( 95 min )

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Reinventing enterprise computing for the modern era, VMware CEO Raghu Raghuram Tuesday announced the availability of the VMware vSphere 8 enterprise workload platform running on NVIDIA DPUs, or data processing units, an initiative formerly known as Project Monterey. Placing the announcement in context, Raghuram and NVIDIA founder and CEO Jensen Huang discussed how running VMware Read article > The post NVIDIA and VMware CEOs Discuss New Era of Enterprise Computing appeared first on NVIDIA Blog.  ( 7 min )

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SkewsMe.com/cyborgs is the latest draft of my paper which was credited in 2005 as the basis for the Wikipedia article about brain implants after being ordered to stand down about cyborgs in 1997. submitted by /u/TheSkewsMe [link] [comments]  ( 87 min )

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I figured out "Emergent tool use from multi-agent autocurricula" from Open AI, I am wondering about other candidates. submitted by /u/Lostefra [link] [comments]  ( 87 min )

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Has anyone seen an implementation of this anywhere? I've been looking for a drill down beyond the paper on youtube/GitHub but can't seem to find anything. Has anyone else had any luck? submitted by /u/atomicburn125 [link] [comments]  ( 87 min )

I have a little knowledge of RL. Years ago I completed the University of Alberta course on Coursera. But time flows, I forgotten almost everything and I'm studying Sutton Barto a second time: sorry if the question looks stupid. I'm refreshing Dynamic Programming chapter. I have seen this pseudocode: https://preview.redd.it/dqnq46es2tk91.png?width=1018&format=png&auto=webp&s=ec8f8b27a8c3715661ac383928100c7fd254722c For me it's wrong. There is maybe something very simple I'm missing but I cannot understand how this can be correct. For me the correct version is as above but with 2 lines of difference: Δ <- +inf .... Δ <- min(Δ, |v-V(s)|) submitted by /u/Moist_Turnip [link] [comments]  ( 88 min )

With personalized content more likely to drive customer engagement, businesses continuously seek to provide tailored content based on their customer’s profile and behavior. Recommendation systems in particular seek to predict the preference an end-user would give to an item. Some common use cases include product recommendations on online retail stores, personalizing newsletters, generating music playlist […]  ( 9 min )

On its own, a new machine-learning model discovers linguistic rules that often match up with those created by human experts.  ( 9 min )

Blog posts about modal logic Typesetting modal logic Modal and temporal logic for security Word problems, modal logic, and regular expressions Axioms for S1 through S5 Naming and numbering modal logic systems Modal logic and science fiction Dual axioms Temporal and polymodal logics I created the image above by asking DALL-E 2 for an image […] Modal logic posts first appeared on John D. Cook.  ( 4 min )

This paper studies distributed Bayesian learning in a setting encompassing a central server and multiple workers by focusing on the problem of mitigating the impact of stragglers. The standard one-shot, or embarrassingly parallel, Bayesian learning protocol known as consensus Monte Carlo (CMC) is generalized by proposing two straggler-resilient solutions based on grouping and coding. Two main challenges in designing straggler-resilient algorithms for CMC are the need to estimate the statistics of the workers' outputs across multiple shots, and the joint non-linear post-processing of the outputs of the workers carried out at the server. This is in stark contrast to other distributed settings like gradient coding, which only require the per-shot sum of the workers' outputs. The proposed methods, referred to as Group-based CMC (G-CMC) and Coded CMC (C-CMC), leverage redundant computing at the workers in order to enable the estimation of global posterior samples at the server based on partial outputs from the workers. Simulation results show that C-CMC may outperform G-CMC for a small number of workers, while G-CMC is generally preferable for a larger number of workers.

This paper discusses a new approach to the fundamental problem of learning optimal Q-functions. In this approach, optimal Q-functions are formulated as saddle points of a nonlinear Lagrangian function derived from the classic Bellman optimality equation. The paper shows that the Lagrangian enjoys strong duality, in spite of its nonlinearity, which paves the way to a general Lagrangian method to Q-function learning. As a demonstration, the paper develops an imitation learning algorithm based on the duality theory, and applies the algorithm to a state-of-the-art machine translation benchmark. The paper then turns to demonstrate a symmetry breaking phenomenon regarding the optimality of the Lagrangian saddle points, which justifies a largely overlooked direction in developing the Lagrangian method.

We consider transfer learning approaches that fine-tune a pretrained deep neural network on a target task. We study generalization properties of fine-tuning to understand the problem of overfitting, which commonly occurs in practice. Previous works have shown that constraining the distance from the initialization of fine-tuning improves generalization. Using a PAC-Bayesian analysis, we observe that besides distance from initialization, Hessians affect generalization through the noise stability of deep neural networks against noise injections. Motivated by the observation, we develop Hessian distance-based generalization bounds for a wide range of fine-tuning methods. Additionally, we study the robustness of fine-tuning in the presence of noisy labels. Motivated by our theory, we design an algorithm that incorporates consistent losses and distance-based regularization for fine-tuning, along with a generalization error guarantee under class conditional independent noise in the training set labels. We perform a detailed empirical study of our algorithm on various noisy environments and architectures. On six image classification tasks whose training labels are generated with programmatic labeling, we find a 3.26% accuracy gain over prior fine-tuning methods. Meanwhile, the Hessian distance measure of the fine-tuned model decreases by six times more than existing approaches.

Contrastive learning has become a key component of self-supervised learning approaches for graph-structured data. Despite their success, existing graph contrastive learning methods are incapable of uncertainty quantification for node representations or their downstream tasks, limiting their application in high-stakes domains. In this paper, we propose a novel Bayesian perspective of graph contrastive learning methods showing random augmentations leads to stochastic encoders. As a result, our proposed method represents each node by a distribution in the latent space in contrast to existing techniques which embed each node to a deterministic vector. By learning distributional representations, we provide uncertainty estimates in downstream graph analytics tasks and increase the expressive power of the predictive model. In addition, we propose a Bayesian framework to infer the probability of perturbations in each view of the contrastive model, eliminating the need for a computationally expensive search for hyperparameter tuning. We empirically show a considerable improvement in performance compared to existing state-of-the-art methods on several benchmark datasets.

Group fairness ensures that the outcome of machine learning (ML) based decision making systems are not biased towards a certain group of people defined by a sensitive attribute such as gender or ethnicity. Achieving group fairness in Federated Learning (FL) is challenging because mitigating bias inherently requires using the sensitive attribute values of all clients, while FL is aimed precisely at protecting privacy by not giving access to the clients' data. As we show in this paper, this conflict between fairness and privacy in FL can be resolved by combining FL with Secure Multiparty Computation (MPC) and Differential Privacy (DP). In doing so, we propose a method for training group-fair ML models in cross-device FL under complete and formal privacy guarantees, without requiring the clients to disclose their sensitive attribute values.

Deep neural networks (DNNs) are increasingly being employed in safety-critical systems, and there is an urgent need to guarantee their correctness. Consequently, the verification community has devised multiple techniques and tools for verifying DNNs. When DNN verifiers discover an input that triggers an error, that is easy to confirm; but when they report that no error exists, there is no way to ensure that the verification tool itself is not flawed. As multiple errors have already been observed in DNN verification tools, this calls the applicability of DNN verification into question. In this work, we present a novel mechanism for enhancing Simplex-based DNN verifiers with proof production capabilities: the generation of an easy-to-check witness of unsatisfiability, which attests to the absence of errors. Our proof production is based on an efficient adaptation of the well-known Farkas' lemma, combined with mechanisms for handling piecewise-linear functions and numerical precision errors. As a proof of concept, we implemented our technique on top of the Marabou DNN verifier. Our evaluation on a safety-critical system for airborne collision avoidance shows that proof production succeeds in almost all cases and requires only minimal overhead.

This paper studies the problem of forecasting general stochastic processes using an extension of the Neural Jump ODE (NJ-ODE) framework. While NJ-ODE was the first framework to establish convergence guarantees for the prediction of irregularly observed time-series, these results were limited to data stemming from It\^o-diffusions with complete observations, in particular Markov processes where all coordinates are observed simultaneously. In this work, we generalise these results to generic, possibly non-Markovian or discontinuous, stochastic processes with incomplete observations, by utilising the reconstruction properties of the signature transform. These theoretical results are supported by empirical studies, where it is shown that the path-dependent NJ-ODE outperforms the original NJ-ODE framework in the case of non-Markovian data. Moreover, we show that PD-NJ-ODE can be applied successfully to limit order book (LOB) data.

In recent years, segmentation methods based on deep convolutional neural networks (CNNs) have made state-of-the-art achievements for many medical analysis tasks. However, most of these approaches improve performance by optimizing the structure or adding new functional modules of the U-Net, which ignoring the complementation and fusion of the coarse-grained and fine-grained semantic information. To solve the above problems, we propose a medical image segmentation framework called progressive learning network (PL-Net), which includes internal progressive learning (IPL) and external progressive learning (EPL). PL-Net has the following advantages: (1) IPL divides feature extraction into two "steps", which can mix different size receptive fields and capture semantic information from coarse to fine granularity without introducing additional parameters; (2) EPL divides the training process into two "stages" to optimize parameters, and realizes the fusion of coarse-grained information in the previous stage and fine-grained information in the latter stage. We evaluate our method in different medical image analysis tasks, and the results show that the segmentation performance of PL-Net is better than the state-of-the-art methods of U-Net and its variants.

Learning-to-rank, a machine learning technique widely used in information retrieval, has recently been applied to the problem of ligand-based virtual screening, to accelerate the early stages of new drug development. Ranking prediction models learn based on ordinal relationships, making them suitable for integrating assay data from various environments. Existing studies of rank prediction in compound screening have generally used a learning-to-rank method called RankSVM. However, they have not been compared with or validated against the gradient boosting decision tree (GBDT)-based learning-to-rank methods that have gained popularity recently. Furthermore, although the ranking metric called Normalized Discounted Cumulative Gain (NDCG) is widely used in information retrieval, it only determines whether the predictions are better than those of other models. In other words, NDCG is incapable of recognizing when a prediction model produces worse than random results. Nevertheless, NDCG is still used in the performance evaluation of compound screening using learning-to-rank. This study used the GBDT model with ranking loss functions, called lambdarank and lambdaloss, for ligand-based virtual screening; results were compared with existing RankSVM methods and GBDT models using regression. We also proposed a new ranking metric, Normalized Enrichment Discounted Cumulative Gain (NEDCG), which aims to properly evaluate the goodness of ranking predictions. Results showed that the GBDT model with learning-to-rank outperformed existing regression methods using GBDT and RankSVM on diverse datasets. Moreover, NEDCG showed that predictions by regression were comparable to random predictions in multi-assay, multi-family datasets, demonstrating its usefulness for a more direct assessment of compound screening performance.

In this research, we show how to expand existing approaches of using generative adversarial networks (GANs) as economic scenario generators (ESG) to a whole internal market risk model - with enough risk factors to model the full band-width of investments for an insurance company and for a one year time horizon as required in Solvency 2. We demonstrate that the results of a GAN-based internal model are similar to regulatory approved internal models in Europe. Therefore, GAN-based models can be seen as a data-driven alternative way of market risk modeling.

Reinforcement learning remains one of the major directions of the contemporary development of control engineering and machine learning. Nice intuition, flexible settings, ease of application are among the many perks of this methodology. From the standpoint of machine learning, the main strength of a reinforcement learning agent is its ability to "capture" (learn) the optimal behavior in the given environment. Typically, the agent is built on neural networks and it is their approximation abilities that give rise to the above belief. From the standpoint of control engineering, however, reinforcement learning has serious deficiencies. The most significant one is the lack of stability guarantee of the agent-environment closed loop. A great deal of research was and is being made towards stabilizing reinforcement learning. Speaking of stability, the celebrated Lyapunov theory is the de facto tool. It is thus no wonder that so many techniques of stabilizing reinforcement learning rely on the Lyapunov theory in one way or another. In control theory, there is an intricate connection between a stabilizing controller and a Lyapunov function. Employing such a pair seems thus quite attractive to design stabilizing reinforcement learning. However, computation of a Lyapunov function is generally a cumbersome process. In this note, we show how to construct a stabilizing reinforcement learning agent that does not employ such a function at all. We only assume that a Lyapunov function exists, which is a natural thing to do if the given system (read: environment) is stabilizable, but we do not need to compute one.

Getting up from an arbitrary fallen state is a basic human skill. Existing methods for learning this skill often generate highly dynamic and erratic get-up motions, which do not resemble human get-up strategies, or are based on tracking recorded human get-up motions. In this paper, we present a staged approach using reinforcement learning, without recourse to motion capture data. The method first takes advantage of a strong character model, which facilitates the discovery of solution modes. A second stage then learns to adapt the control policy to work with progressively weaker versions of the character. Finally, a third stage learns control policies that can reproduce the weaker get-up motions at much slower speeds. We show that across multiple runs, the method can discover a diverse variety of get-up strategies, and execute them at a variety of speeds. The results usually produce policies that use a final stand-up strategy that is common to the recovery motions seen from all initial states. However, we also find policies for which different strategies are seen for prone and supine initial fallen states. The learned get-up control strategies often have significant static stability, i.e., they can be paused at a variety of points during the get-up motion. We further test our method on novel constrained scenarios, such as having a leg and an arm in a cast.

Humans can make predictions on various time scales and hierarchical levels. Thereby, the learning of event encodings seems to play a crucial role. In this work we model the development of hierarchical predictions via autonomously learned latent event codes. We present a hierarchical recurrent neural network architecture, whose inductive learning biases foster the development of sparsely changing latent state that compress sensorimotor sequences. A higher level network learns to predict the situations in which the latent states tend to change. Using a simulated robotic manipulator, we demonstrate that the system (i) learns latent states that accurately reflect the event structure of the data, (ii) develops meaningful temporal abstract predictions on the higher level, and (iii) generates goal-anticipatory behavior similar to gaze behavior found in eye-tracking studies with infants. The architecture offers a step towards the autonomous learning of compressed hierarchical encodings of gathered experiences and the exploitation of these encodings to generate adaptive behavior.

Deep neural networks (DNNs) are known to be vulnerable to adversarial examples that are crafted with imperceptible perturbations, i.e., a small change in an input image can induce a mis-classification, and thus threatens the reliability of deep learning based deployment systems. Adversarial training (AT) is often adopted to improve robustness through training a mixture of corrupted and clean data. However, most of AT based methods are ineffective in dealing with transferred adversarial examples which are generated to fool a wide spectrum of defense models, and thus cannot satisfy the generalization requirement raised in real-world scenarios. Moreover, adversarially training a defense model in general cannot produce interpretable predictions towards the inputs with perturbations, whilst a highly interpretable robust model is required by different domain experts to understand the behaviour of a DNN. In this work, we propose a novel approach based on Jacobian norm and Selective Input Gradient Regularization (J-SIGR), which suggests the linearized robustness through Jacobian normalization and also regularizes the perturbation-based saliency maps to imitate the model's interpretable predictions. As such, we achieve both the improved defense and high interpretability of DNNs. Finally, we evaluate our method across different architectures against powerful adversarial attacks. Experiments demonstrate that the proposed J-SIGR confers improved robustness against transferred adversarial attacks, and we also show that the predictions from the neural network are easy to interpret.

Graph Neural Networks (GNNs) are a popular technique for modelling graph-structured data and computing node-level representations via aggregation of information from the neighborhood of each node. However, this aggregation implies an increased risk of revealing sensitive information, as a node can participate in the inference for multiple nodes. This implies that standard privacy-preserving machine learning techniques, such as differentially private stochastic gradient descent (DP-SGD) - which are designed for situations where each data point participates in the inference for one point only - either do not apply, or lead to inaccurate models. In this work, we formally define the problem of learning GNN parameters with node-level privacy, and provide an algorithmic solution with a strong differential privacy guarantee. We employ a careful sensitivity analysis and provide a non-trivial extension of the privacy-by-amplification technique to the GNN setting. An empirical evaluation on standard benchmark datasets demonstrates that our method is indeed able to learn accurate privacy-preserving GNNs which outperform both private and non-private methods that completely ignore graph information.

Let $\mathscr{F}_{n,d}$ be the class of all functions $f:\{-1,1\}^n\to[-1,1]$ on the $n$-dimensional discrete hypercube of degree at most $d$. In the first part of this paper, we prove that any (deterministic or randomized) algorithm which learns $\mathscr{F}_{n,d}$ with $L_2$-accuracy $\varepsilon$ requires at least $\Omega((1-\sqrt{\varepsilon})2^d\log n)$ queries for large enough $n$, thus establishing the sharpness as $n\to\infty$ of a recent upper bound of Eskenazis and Ivanisvili (2021). To do this, we show that the $L_2$-packing numbers $\mathsf{M}(\mathscr{F}_{n,d},\|\cdot\|_{L_2},\varepsilon)$ of the concept class $\mathscr{F}_{n,d}$ satisfy the two-sided estimate $$c(1-\varepsilon)2^d\log n \leq \log \mathsf{M}(\mathscr{F}_{n,d},\|\cdot\|_{L_2},\varepsilon) \leq \frac{2^{Cd}\log n}{\varepsilon^4}$$ for large enough $n$, where $c, C>0$ are universal constants. In the second part of the paper, we present a logarithmic upper bound for the randomized query complexity of classes of bounded approximate polynomials whose Fourier spectra are concentrated on few subsets. As an application, we prove new estimates for the number of random queries required to learn approximate juntas of a given degree, functions with rapidly decaying Fourier tails and constant depth circuits of given size. Finally, we obtain bounds for the number of queries required to learn the polynomial class $\mathscr{F}_{n,d}$ without error in the query and random example models.

Artificial intelligence, particularly through recent advancements in deep learning, has achieved exceptional performances in many tasks in fields such as natural language processing and computer vision. In addition to desirable evaluation metrics, a high level of interpretability is often required for these models to be reliably utilized. Therefore, explanations that offer insight into the process by which a model maps its inputs onto its outputs are much sought-after. Unfortunately, the current black box nature of machine learning models is still an unresolved issue and this very nature prevents researchers from learning and providing explicative descriptions for a model's behavior and final predictions. In this work, we propose a novel framework utilizing Adversarial Inverse Reinforcement Learning that can provide global explanations for decisions made by a Reinforcement Learning model and capture intuitive tendencies that the model follows by summarizing the model's decision-making process.

Equivariance to symmetries has proven to be a powerful inductive bias in deep learning research. Recent works on mesh processing have concentrated on various kinds of natural symmetries, including translations, rotations, scaling, node permutations, and gauge transformations. To date, no existing architecture is equivariant to all of these transformations. In this paper, we present an attention-based architecture for mesh data that is provably equivariant to all transformations mentioned above. Our pipeline relies on the use of relative tangential features: a simple, effective, equivariance-friendly alternative to raw node positions as inputs. Experiments on the FAUST and TOSCA datasets confirm that our proposed architecture achieves improved performance on these benchmarks and is indeed equivariant, and therefore robust, to a wide variety of local/global transformations.

One of the core problems in mean-field control and mean-field games is to solve the corresponding McKean-Vlasov forward-backward stochastic differential equations (MV-FBSDEs). Most existing methods are tailored to special cases in which the mean-field interaction only depends on expectation or other moments and thus inadequate to solve problems when the mean-field interaction has full distribution dependence. In this paper, we propose a novel deep learning method for computing MV-FBSDEs with a general form of mean-field interactions. Specifically, built on fictitious play, we recast the problem into repeatedly solving standard FBSDEs with explicit coefficient functions. These coefficient functions are used to approximate the MV-FBSDEs' model coefficients with full distribution dependence, and are updated by solving another supervising learning problem using training data simulated from the last iteration's FBSDE solutions. We use deep neural networks to solve standard BSDEs and approximate coefficient functions in order to solve high-dimensional MV-FBSDEs. Under proper assumptions on the learned functions, we prove that the convergence of the proposed method is free of the curse of dimensionality (CoD) by using a class of integral probability metrics previously developed in [Han, Hu and Long, arXiv:2104.12036]. The proved theorem shows the advantage of the method in high dimensions. We present the numerical performance in high-dimensional MV-FBSDE problems, including a mean-field game example of the well-known Cucker-Smale model whose cost depends on the full distribution of the forward process.

There has been a rising interest in graph neural networks (GNNs) for representation learning over the past few years. GNNs provide a general and efficient framework to learn from graph-structured data. However, GNNs typically only use the information of a very limited neighborhood for each node to avoid over-smoothing. A larger neighborhood would be desirable to provide the model with more information. In this work, we incorporate the limit distribution of Personalized PageRank (PPR) into graph attention networks (GATs) to reflect the larger neighbor information without introducing over-smoothing. Intuitively, message aggregation based on Personalized PageRank corresponds to infinitely many neighborhood aggregation layers. We show that our models outperform a variety of baseline models for four widely used benchmark datasets. Our implementation is publicly available online.

We consider extensions of the Shannon relative entropy, referred to as f-divergences. Three classical related computational problems are typically associated with these divergences: (a) estimation from moments, (b) computing normalizing integrals, and (c) variational inference in probabilistic models. These problems are related to one another through convex duality, and for all them, there are many applications throughout data science, and we aim for computationally tractable approximation algorithms that preserve properties of the original problem such as potential convexity or monotonicity. In order to achieve this, we derive a sequence of convex relaxations for computing these divergences from non-centered covariance matrices associated with a given feature vector: starting from the typically non-tractable optimal lower-bound, we consider an additional relaxation based on "sums-of-squares", which is is now computable in polynomial time as a semidefinite program, as well as further computationally more efficient relaxations based on spectral information divergences from quantum information theory. For all of the tasks above, beyond proposing new relaxations, we derive tractable algorithms based on augmented Lagrangians and first-order methods, and we present illustrations on multivariate trigonometric polynomials and functions on the Boolean hypercube.

We study the functional relationship between quantum control pulses in the idealized case and the pulses in the presence of an unwanted drift. We show that a class of artificial neural networks called LSTM is able to model this functional relationship with high efficiency, and hence the correction scheme required to counterbalance the effect of the drift. Our solution allows studying the mapping from quantum control pulses to system dynamics and then analysing the robustness of the latter against local variations in the control profile.

Alignment between non-rigid stretchable structures is one of the most challenging tasks in computer vision, as the invariant properties are hard to define, and there is no labeled data for real datasets. We present unsupervised neural network architecture based upon the spectral domain of scale-invariant geometry. We build on top of the functional maps architecture, but show that learning local features, as done until now, is not enough once the isometry assumption breaks. We demonstrate the use of multiple scale-invariant geometries for solving this problem. Our method is agnostic to local-scale deformations and shows superior performance for matching shapes from different domains when compared to existing spectral state-of-the-art solutions.

We study the problem of variance estimation in general graph-structured problems. First, we develop a linear time estimator for the homoscedastic case that can consistently estimate the variance in general graphs. We show that our estimator attains minimax rates for the chain and 2D grid graphs when the mean signal has a total variation with canonical scaling. Furthermore, we provide general upper bounds on the mean squared error performance of the fused lasso estimator in general graphs under a moment condition and a bound on the tail behavior of the errors. These upper bounds allow us to generalize for broader classes of distributions, such as sub-Exponential, many existing results on the fused lasso that are only known to hold with the assumption that errors are sub-Gaussian random variables. Exploiting our upper bounds, we then study a simple total variation regularization estimator for estimating the signal of variances in the heteroscedastic case. Our results show that the variance estimator attains minimax rates for estimating signals of bounded variation in grid graphs, $K$-nearest neighbor graphs with very mild assumptions, and it is consistent for estimating the variances in any connected graph. In addition, extensive numerical results show that our proposed estimators perform reasonably well in a variety of graph-structured models.

Differential privacy has been an exceptionally successful concept when it comes to providing provable security guarantees for classical computations. More recently, the concept was generalized to quantum computations. While classical computations are essentially noiseless and differential privacy is often achieved by artificially adding noise, near-term quantum computers are inherently noisy and it was observed that this leads to natural differential privacy as a feature. In this work we discuss quantum differential privacy in an information theoretic framework by casting it as a quantum divergence. A main advantage of this approach is that differential privacy becomes a property solely based on the output states of the computation, without the need to check it for every measurement. This leads to simpler proofs and generalized statements of its properties as well as several new bounds for both, general and specific, noise models. In particular, these include common representations of quantum circuits and quantum machine learning concepts. Here, we focus on the difference in the amount of noise required to achieve certain levels of differential privacy versus the amount that would make any computation useless. Finally, we also generalize the classical concepts of local differential privacy, R\'enyi differential privacy and the hypothesis testing interpretation to the quantum setting, providing several new properties and insights.

We propose a novel robust decentralized graph clustering algorithm that is provably equivalent to the popular spectral clustering approach. Our proposed method uses the existing wave equation clustering algorithm that is based on propagating waves through the graph. However, instead of using a fast Fourier transform (FFT) computation at every node, our proposed approach exploits the Koopman operator framework. Specifically, we show that propagating waves in the graph followed by a local dynamic mode decomposition (DMD) computation at every node is capable of retrieving the eigenvalues and the local eigenvector components of the graph Laplacian, thereby providing local cluster assignments for all nodes. We demonstrate that the DMD computation is more robust than the existing FFT based approach and requires 20 times fewer steps of the wave equation to accurately recover the clustering information and reduces the relative error by orders of magnitude. We demonstrate the decentralized approach on a range of graph clustering problems.

Non-deterministic measurements are common in real-world scenarios: the performance of a stochastic optimization algorithm or the total reward of a reinforcement learning agent in a chaotic environment are just two examples in which unpredictable outcomes are common. These measures can be modeled as random variables and compared among each other via their expected values or more sophisticated tools such as null hypothesis statistical tests. In this paper, we propose an alternative framework to visually compare two samples according to their estimated cumulative distribution functions. First, we introduce a dominance measure for two random variables that quantifies the proportion in which the cumulative distribution function of one of the random variables scholastically dominates the other one. Then, we present a graphical method that decomposes in quantiles i) the proposed dominance measure and ii) the probability that one of the random variables takes lower values than the other. With illustrative purposes, we re-evaluate the experimentation of an already published work with the proposed methodology and we show that additional conclusions (missed by the rest of the methods) can be inferred. Additionally, the software package RVCompare was created as a convenient way of applying and experimenting with the proposed framework.

Free-standing social conversations constitute a yet underexplored setting for human behavior forecasting. While the task of predicting pedestrian trajectories has received much recent attention, an intrinsic difference between these settings is how groups form and disband. Evidence from social psychology suggests that group members in a conversation explicitly self-organize to sustain the interaction by adapting to one another's behaviors. Crucially, the same individual is unlikely to adapt similarly across different groups; contextual factors such as perceived relationships, attraction, rapport, etc., influence the entire spectrum of participants' behaviors. A question arises: how can we jointly forecast the mutually dependent futures of conversation partners by modeling the dynamics unique to every group? In this paper, we propose the Social Process (SP) models, taking a novel meta-learning and stochastic perspective of group dynamics. Training group-specific forecasting models hinders generalization to unseen groups and is challenging given limited conversation data. In contrast, our SP models treat interaction sequences from a single group as a meta-dataset: we condition forecasts for a sequence from a given group on other observed-future sequence pairs from the same group. In this way, an SP model learns to adapt its forecasts to the unique dynamics of the interacting partners, generalizing to unseen groups in a data-efficient manner. Additionally, we first rethink the task formulation itself, motivating task requirements from social science literature that prior formulations have overlooked. For our formulation of Social Cue Forecasting, we evaluate the empirical performance of our SP models against both non-meta-learning and meta-learning approaches with similar assumptions. The SP models yield improved performance on synthetic and real-world behavior datasets.

The task of shape space learning involves mapping a train set of shapes to and from a latent representation space with good generalization properties. Often, real-world collections of shapes have symmetries, which can be defined as transformations that do not change the essence of the shape. A natural way to incorporate symmetries in shape space learning is to ask that the mapping to the shape space (encoder) and mapping from the shape space (decoder) are equivariant to the relevant symmetries. In this paper, we present a framework for incorporating equivariance in encoders and decoders by introducing two contributions: (i) adapting the recent Frame Averaging (FA) framework for building generic, efficient, and maximally expressive Equivariant autoencoders; and (ii) constructing autoencoders equivariant to piecewise Euclidean motions applied to different parts of the shape. To the best of our knowledge, this is the first fully piecewise Euclidean equivariant autoencoder construction. Training our framework is simple: it uses standard reconstruction losses and does not require the introduction of new losses. Our architectures are built of standard (backbone) architectures with the appropriate frame averaging to make them equivariant. Testing our framework on both rigid shapes dataset using implicit neural representations, and articulated shape datasets using mesh-based neural networks show state-of-the-art generalization to unseen test shapes, improving relevant baselines by a large margin. In particular, our method demonstrates significant improvement in generalizing to unseen articulated poses.

Accurate traffic prediction is a key ingredient to enable traffic management like rerouting cars to reduce road congestion or regulating traffic via dynamic speed limits to maintain a steady flow. A way to represent traffic data is in the form of temporally changing heatmaps visualizing attributes of traffic, such as speed and volume. In recent works, U-Net models have shown SOTA performance on traffic forecasting from heatmaps. We propose to combine the U-Net architecture with graph layers which improves spatial generalization to unseen road networks compared to a Vanilla U-Net. In particular, we specialize existing graph operations to be sensitive to geographical topology and generalize pooling and upsampling operations to be applicable to graphs.

Recently, deep neural network (DNN)-based physical layer communication techniques have attracted considerable interest. Although their potential to enhance communication systems and superb performance have been validated by simulation experiments, little attention has been paid to the theoretical analysis. Specifically, most studies in the physical layer have tended to focus on the application of DNN models to wireless communication problems but not to theoretically understand how does a DNN work in a communication system. In this paper, we aim to quantitatively analyze why DNNs can achieve comparable performance in the physical layer comparing with traditional techniques, and also drive their cost in terms of computational complexity. To achieve this goal, we first analyze the encoding performance of a DNN-based transmitter and compare it to a traditional one. And then, we theoretically analyze the performance of DNN-based estimator and compare it with traditional estimators. Third, we investigate and validate how information is flown in a DNN-based communication system under the information theoretic concepts. Our analysis develops a concise way to open the "black box" of DNNs in physical layer communication, which can be applied to support the design of DNN-based intelligent communication techniques and help to provide explainable performance assessment.

There has been an explosion of interest in designing high-performance Transformers. While Transformers have delivered significant performance improvements, training such networks is extremely memory intensive owing to storing all intermediate activations that are needed for gradient computation during backpropagation, especially for long sequences. To this end, we present Mesa, a memory-saving training framework for Transformers. Specifically, Mesa uses exact activations during forward pass while storing a low-precision version of activations to reduce memory consumption during training. The low-precision activations are then dequantized during back-propagation to compute gradients. Besides, to address the heterogeneous activation distributions in the multi-head self-attention layers, we propose a head-wise activation quantization strategy, which quantizes activations based on the statistics of each head to minimize the approximation error. To further boost training efficiency, we learn quantization parameters by running estimates. More importantly, by re-investing the saved memory in employing a larger batch size or scaling up model size, we may further improve the performance under constrained computational resources. Extensive experiments on ImageNet, CIFAR-100 and ADE20K demonstrate that Mesa can achieve flexible memory-savings (up to 50%) during training while achieving comparable or even better performance. Code is available at https://github.com/ziplab/Mesa.

The remarkable successes of neural networks in a huge variety of inverse problems have fueled their adoption in disciplines ranging from medical imaging to seismic analysis over the past decade. However, the high dimensionality of such inverse problems has simultaneously left current theory, which predicts that networks should scale exponentially in the dimension of the problem, unable to explain why the seemingly small networks used in these settings work as well as they do in practice. To reduce this gap between theory and practice, a general method for bounding the complexity required for a neural network to approximate a Lipschitz function on a high-dimensional set with a low-complexity structure is provided herein. The approach is based on the observation that the existence of a linear Johnson-Lindenstrauss embedding $\mathbf{A} \in \mathbb{R}^{d \times D}$ of a given high-dimensional set $\mathcal{S} \subset \mathbb{R}^D$ into a low dimensional cube $[-M,M]^d$ implies that for any Lipschitz function $f : \mathcal{S}\to \mathbb{R}^p$, there exists a Lipschitz function $g : [-M,M]^d \to \mathbb{R}^p$ such that $g(\mathbf{A}\mathbf{x}) = f(\mathbf{x})$ for all $\mathbf{x} \in \mathcal{S}$. Hence, if one has a neural network which approximates $g : [-M,M]^d \to \mathbb{R}^p$, then a layer can be added which implements the JL embedding $\mathbf{A}$ to obtain a neural network which approximates $f : \mathcal{S} \to \mathbb{R}^p$. By pairing JL embedding results along with results on approximation of Lipschitz functions by neural networks, one then obtains results which bound the complexity required for a neural network to approximate Lipschitz functions on high dimensional sets. The end result is a general theoretical framework which can then be used to better explain the observed empirical successes of smaller networks in a wider variety of inverse problems than current theory allows.

For centuries, scientists have observed nature to understand the laws that govern the physical world. The traditional process of turning observations into physical understanding is slow. Imperfect models are constructed and tested to explain relationships in data. Powerful new algorithms can enable computers to learn physics by observing images and videos. Inspired by this idea, instead of training machine learning models using physical quantities, we used images, that is, pixel information. For this work, and as a proof of concept, the physics of interest are wind-driven spatial patterns. These phenomena include features in Aeolian dunes and volcanic ash deposition, wildfire smoke, and air pollution plumes. We use computer model simulations of spatial deposition patterns to approximate images from a hypothetical imaging device whose outputs are red, green, and blue (RGB) color images with channel values ranging from 0 to 255. In this paper, we explore deep convolutional neural network-based autoencoders to exploit relationships in wind-driven spatial patterns, which commonly occur in geosciences, and reduce their dimensionality. Reducing the data dimension size with an encoder enables training deep, fully connected neural network models linking geographic and meteorological scalar input quantities to the encoded space. Once this is achieved, full spatial patterns are reconstructed using the decoder. We demonstrate this approach on images of spatial deposition from a pollution source, where the encoder compresses the dimensionality to 0.02% of the original size, and the full predictive model performance on test data achieves an accuracy of 92%.

The advances in data science and machine learning have resulted in significant improvements regarding the modeling and simulation of nonlinear dynamical systems. It is nowadays possible to make accurate predictions of complex systems such as the weather, disease models or the stock market. Predictive methods are often advertised to be useful for control, but the specifics are frequently left unanswered due to the higher system complexity, the requirement of larger data sets and an increased modeling effort. In other words, surrogate modeling for autonomous systems is much easier than for control systems. In this paper we present the framework QuaSiModO (Quantization-Simulation-Modeling-Optimization) to transform arbitrary predictive models into control systems and thus render the tremendous advances in data-driven surrogate modeling accessible for control. Our main contribution is that we trade control efficiency by autonomizing the dynamics - which yields mixed-integer control problems - to gain access to arbitrary, ready-to-use autonomous surrogate modeling techniques. We then recover the complexity of the original problem by leveraging recent results from mixed-integer optimization. The advantages of QuaSiModO are a linear increase in data requirements with respect to the control dimension, performance guarantees that rely exclusively on the accuracy of the predictive model in use, and little prior knowledge requirements in control theory to solve complex control problems.

Quantum state tomography (QST), the task of estimating an unknown quantum state given measurement outcomes, is essential to building reliable quantum computing devices. Whereas computing the maximum-likelihood (ML) estimate corresponds to solving a finite-sum convex optimization problem, the objective function is not smooth nor Lipschitz, so most existing convex optimization methods lack sample complexity guarantees; moreover, both the sample size and dimension grow exponentially with the number of qubits in a QST experiment, so a desired algorithm should be highly scalable with respect to the dimension and sample size, just like stochastic gradient descent. In this paper, we propose a stochastic first-order algorithm that computes an $\varepsilon$-approximate ML estimate in $O( ( D \log D ) / \varepsilon ^ 2 )$ iterations with $O( D^3 )$ per-iteration time complexity, where $D$ denotes the dimension of the unknown quantum state and $\varepsilon$ denotes the optimization error. Our algorithm is an extension of Soft-Bayes to the quantum setup.

Dynamical systems with interacting agents are universal in nature, commonly modeled by a graph of relationships between their constituents. Recently, various works have been presented to tackle the problem of inferring those relationships from the system trajectories via deep neural networks, but most of the studies assume binary or discrete types of interactions for simplicity. In the real world, the interaction kernels often involve continuous interaction strengths, which cannot be accurately approximated by discrete relations. In this work, we propose the relational attentive inference network (RAIN) to infer continuously weighted interaction graphs without any ground-truth interaction strengths. Our model employs a novel pairwise attention (PA) mechanism to refine the trajectory representations and a graph transformer to extract heterogeneous interaction weights for each pair of agents. We show that our RAIN model with the PA mechanism accurately infers continuous interaction strengths for simulated physical systems in an unsupervised manner. Further, RAIN with PA successfully predicts trajectories from motion capture data with an interpretable interaction graph, demonstrating the virtue of modeling unknown dynamics with continuous weights.

We study a constructive algorithm that approximates Gateaux derivatives for statistical functionals by finite-differencing, with a focus on causal inference functionals. We consider the case where probability distributions are not known a priori but also need to be estimated from data. These estimated distributions lead to empirical Gateaux derivatives, and we study the relationships between empirical, numerical, and analytical Gateaux derivatives. Starting with a case study of counterfactual mean estimation, we instantiate the exact relationship between finite-differences and the analytical Gateaux derivative. We then derive requirements on the rates of numerical approximation in perturbation and smoothing that preserve the statistical benefits of one-step adjustments, such as rate-double-robustness. We then study more complicated functionals such as dynamic treatment regimes and the linear-programming formulation for policy optimization in infinite-horizon Markov decision processes. The newfound ability to approximate bias adjustments in the presence of arbitrary constraints illustrates the usefulness of constructive approaches for Gateaux derivatives. We also find that the statistical structure of the functional (rate-double robustness) can permit less conservative rates of finite-difference approximation. This property, however, can be specific to particular functionals, e.g. it occurs for the counterfactual mean but not the infinite-horizon MDP policy value.

Quite some real-world problems can be formulated as decision-making problems wherein one must repeatedly make an appropriate choice from a set of alternatives. Multiple expert judgements, whether human or artificial, can help in taking correct decisions, especially when exploration of alternative solutions is costly. As expert opinions might deviate, the problem of finding the right alternative can be approached as a collective decision making problem (CDM) via aggregation of independent judgements. Current state-of-the-art approaches focus on efficiently finding the optimal expert, and thus perform poorly if all experts are not qualified or if they are overly biased, thereby potentially derailing the decision-making process. In this paper, we propose a new algorithmic approach based on contextual multi-armed bandit problems (CMAB) to identify and counteract such biased expertise. We explore homogeneous, heterogeneous and polarised expert groups and show that this approach is able to effectively exploit the collective expertise, outperforming state-of-the-art methods, especially when the quality of the provided expertise degrades. Our novel CMAB-inspired approach achieves a higher final performance and does so while converging more rapidly than previous adaptive algorithms.

This paper presents the Persistent Weisfeiler-Lehman Random walk scheme (abbreviated as PWLR) for graph representations, a novel mathematical framework which produces a collection of explainable low-dimensional representations of graphs with discrete and continuous node features. The proposed scheme effectively incorporates normalized Weisfeiler-Lehman procedure, random walks on graphs, and persistent homology. We thereby integrate three distinct properties of graphs, which are local topological features, node degrees, and global topological invariants, while preserving stability from graph perturbations. This generalizes many variants of Weisfeiler-Lehman procedures, which are primarily used to embed graphs with discrete node labels. Empirical results suggest that these representations can be efficiently utilized to produce comparable results to state-of-the-art techniques in classifying graphs with discrete node labels, and enhanced performances in classifying those with continuous node features.

As an important psychological and social experiment, the Iterated Prisoner's Dilemma (IPD) treats the choice to cooperate or defect as an atomic action. We propose to study the behaviors of online learning algorithms in the Iterated Prisoner's Dilemma (IPD) game, where we investigate the full spectrum of reinforcement learning agents: multi-armed bandits, contextual bandits and reinforcement learning. We evaluate them based on a tournament of iterated prisoner's dilemma where multiple agents can compete in a sequential fashion. This allows us to analyze the dynamics of policies learned by multiple self-interested independent reward-driven agents, and also allows us study the capacity of these algorithms to fit the human behaviors. Results suggest that considering the current situation to make decision is the worst in this kind of social dilemma game. Multiples discoveries on online learning behaviors and clinical validations are stated, as an effort to connect artificial intelligence algorithms with human behaviors and their abnormal states in neuropsychiatric conditions.

Forecasting graph-based time-dependent data has many practical applications. This task is challenging as models need not only to capture spatial dependency and temporal dependency within the data, but also to leverage useful auxiliary information for accurate predictions. In this paper, we analyze limitations of state-of-the-art models on dealing with temporal dependency. To address this limitation, we propose GSA-Forecaster, a new deep learning model for forecasting graph-based time-dependent data. GSA-Forecaster leverages graph sequence attention (GSA), a new attention mechanism proposed in this paper, for effectively capturing temporal dependency. GSA-Forecaster embeds the graph structure of the data into its architecture to address spatial dependency. GSA-Forecaster also accounts for auxiliary information to further improve predictions. We evaluate GSA-Forecaster with large-scale real-world graph-based time-dependent data and demonstrate its effectiveness over state-of-the-art models with 6.7% RMSE and 5.8% MAPE reduction.

Vision Transformers (ViTs) have demonstrated the state-of-the-art performance in various vision-related tasks. The success of ViTs motivates adversaries to perform backdoor attacks on ViTs. Although the vulnerability of traditional CNNs to backdoor attacks is well-known, backdoor attacks on ViTs are seldom-studied. Compared to CNNs capturing pixel-wise local features by convolutions, ViTs extract global context information through patches and attentions. Na\"ively transplanting CNN-specific backdoor attacks to ViTs yields only a low clean data accuracy and a low attack success rate. In this paper, we propose a stealth and practical ViT-specific backdoor attack $TrojViT$. Rather than an area-wise trigger used by CNN-specific backdoor attacks, TrojViT generates a patch-wise trigger designed to build a Trojan composed of some vulnerable bits on the parameters of a ViT stored in DRAM memory through patch salience ranking and attention-target loss. TrojViT further uses minimum-tuned parameter update to reduce the bit number of the Trojan. Once the attacker inserts the Trojan into the ViT model by flipping the vulnerable bits, the ViT model still produces normal inference accuracy with benign inputs. But when the attacker embeds a trigger into an input, the ViT model is forced to classify the input to a predefined target class. We show that flipping only few vulnerable bits identified by TrojViT on a ViT model using the well-known RowHammer can transform the model into a backdoored one. We perform extensive experiments of multiple datasets on various ViT models. TrojViT can classify $99.64\%$ of test images to a target class by flipping $345$ bits on a ViT for ImageNet.

The increasing complexity of modern high-performance computing (HPC) systems necessitates the introduction of automated and data-driven methodologies to support system administrators' effort toward increasing the system's availability. Anomaly detection is an integral part of improving the availability as it eases the system administrator's burden and reduces the time between an anomaly and its resolution. However, current state-of-the-art (SoA) approaches to anomaly detection are supervised and semi-supervised, so they require a human-labelled dataset with anomalies - this is often impractical to collect in production HPC systems. Unsupervised anomaly detection approaches based on clustering, aimed at alleviating the need for accurate anomaly data, have so far shown poor performance. In this work, we overcome these limitations by proposing RUAD, a novel Recurrent Unsupervised Anomaly Detection model. RUAD achieves better results than the current semi-supervised and unsupervised SoA approaches. This is achieved by considering temporal dependencies in the data and including long-short term memory cells in the model architecture. The proposed approach is assessed on a complete ten-month history of a Tier-0 system (Marconi100 from CINECA with 980 nodes). RUAD achieves an area under the curve (AUC) of 0.763 in semi-supervised training and an AUC of 0.767 in unsupervised training, which improves upon the SoA approach that achieves an AUC of 0.747 in semi-supervised training and an AUC of 0.734 in unsupervised training. It also vastly outperforms the current SoA unsupervised anomaly detection approach based on clustering, achieving the AUC of 0.548.

Knowledge tracing (KT) which aims at predicting learner's knowledge mastery plays an important role in the computer-aided educational system. In recent years, many deep learning models have been applied to tackle the KT task, which have shown promising results. However, limitations still exist. Most existing methods simplify the exercising records as knowledge sequences, which fail to explore rich information that existed in exercises. Besides, the existing diagnosis results of knowledge tracing are not convincing enough since they neglect prior relations between exercises. To solve the above problems, we propose a hierarchical graph knowledge tracing model called HGKT to explore the latent hierarchical relations between exercises. Specifically, we introduce the concept of problem schema to construct a hierarchical exercise graph that could model the exercise learning dependencies. Moreover, we employ two attention mechanisms to highlight the important historical states of learners. In the testing stage, we present a K&S diagnosis matrix that could trace the transition of mastery of knowledge and problem schema, which can be more easily applied to different applications. Extensive experiments show the effectiveness and interpretability of our proposed models.

Online advertising has recently grown into a highly competitive and complex multi-billion-dollar industry, with advertisers bidding for ad slots at large scales and high frequencies. This has resulted in a growing need for efficient "auto-bidding" algorithms that determine the bids for incoming queries to maximize advertisers' targets subject to their specified constraints. This work explores efficient online algorithms for a single value-maximizing advertiser under an increasingly popular constraint: Return-on-Spend (RoS). We quantify efficiency in terms of regret relative to the optimal algorithm, which knows all queries a priori. We contribute a simple online algorithm that achieves near-optimal regret in expectation while always respecting the specified RoS constraint when the input sequence of queries are i.i.d. samples from some distribution. We also integrate our results with the previous work of Balseiro, Lu, and Mirrokni [BLM20] to achieve near-optimal regret while respecting both RoS and fixed budget constraints. Our algorithm follows the primal-dual framework and uses online mirror descent (OMD) for the dual updates. However, we need to use a non-canonical setup of OMD, and therefore the classic low-regret guarantee of OMD, which is for the adversarial setting in online learning, no longer holds. Nonetheless, in our case and more generally where low-regret dynamics are applied in algorithm design, the gradients encountered by OMD can be far from adversarial but influenced by our algorithmic choices. We exploit this key insight to show our OMD setup achieves low regret in the realm of our algorithm.

In sequence-to-sequence learning, e.g., natural language generation, the decoder relies on the attention mechanism to efficiently extract information from the encoder. While it is common practice to draw information from only the last encoder layer, recent work has proposed to use representations from different encoder layers for diversified levels of information. Nonetheless, the decoder still obtains only a single view of the source sequences, which might lead to insufficient training of the encoder layer stack due to the hierarchy bypassing problem. In this work, we propose layer-wise multi-view decoding, where for each decoder layer, together with the representations from the last encoder layer, which serve as a global view, those from other encoder layers are supplemented for a stereoscopic view of the source sequences. Systematic experiments and analyses show that we successfully address the hierarchy bypassing problem, require almost negligible parameter increase, and substantially improve the performance of sequence-to-sequence learning with deep representations on five diverse tasks, i.e., machine translation, abstractive summarization, image captioning, video captioning, medical report generation, and paraphrase generation. In particular, our approach achieves new state-of-the-art results on ten benchmark datasets, including a low-resource machine translation dataset and two low-resource medical report generation datasets.

Air pollution is one of the most important causes of mortality in the world. Monitoring air pollution is useful to learn more about the link between health and pollutants, and to identify areas for intervention. Such monitoring is expensive, so it is important to place sensors as efficiently as possible. Bayesian optimisation has proven useful in choosing sensor locations, but typically relies on kernel functions that neglect the statistical structure of air pollution, such as the tendency of pollution to propagate in the prevailing wind direction. We describe two new wind-informed kernels and investigate their advantage for the task of actively learning locations of maximum pollution using Bayesian optimisation.

Modern machine learning tasks often require considering not just one but multiple objectives. For example, besides the prediction quality, this could be the efficiency, robustness or fairness of the learned models, or any of their combinations. Multi-objective learning offers a natural framework for handling such problems without having to commit to early trade-offs. Surprisingly, statistical learning theory so far offers almost no insight into the generalization properties of multi-objective learning. In this work, we make first steps to fill this gap: we establish foundational generalization bounds for the multi-objective setting as well as generalization and excess bounds for learning with scalarizations. We also provide the first theoretical analysis of the relation between the Pareto-optimal sets of the true objectives and the Pareto-optimal sets of their empirical approximations from training data. In particular, we show a surprising asymmetry: all Pareto-optimal solutions can be approximated by empirically Pareto-optimal ones, but not vice versa.

To understand the security threats to reinforcement learning (RL) algorithms, this paper studies poisoning attacks to manipulate \emph{any} order-optimal learning algorithm towards a targeted policy in episodic RL and examines the potential damage of two natural types of poisoning attacks, i.e., the manipulation of \emph{reward} and \emph{action}. We discover that the effect of attacks crucially depend on whether the rewards are bounded or unbounded. In bounded reward settings, we show that only reward manipulation or only action manipulation cannot guarantee a successful attack. However, by combining reward and action manipulation, the adversary can manipulate any order-optimal learning algorithm to follow any targeted policy with $\tilde{\Theta}(\sqrt{T})$ total attack cost, which is order-optimal, without any knowledge of the underlying MDP. In contrast, in unbounded reward settings, we show that reward manipulation attacks are sufficient for an adversary to successfully manipulate any order-optimal learning algorithm to follow any targeted policy using $\tilde{O}(\sqrt{T})$ amount of contamination. Our results reveal useful insights about what can or cannot be achieved by poisoning attacks, and are set to spur more works on the design of robust RL algorithms.

Not all data are equal. Misleading or unnecessary data can critically hinder the accuracy of Machine Learning (ML) models. When data is plentiful, misleading effects can be overcome, but in many real-world applications data is sparse and expensive to acquire. We present a method that substantially reduces the data size necessary to accurately train ML models, potentially opening the door for many new, limited-data applications in ML. Our method extracts the most informative data, while ignoring and omitting data that misleads the ML model to inferior generalization properties. Specifically, the method eliminates the phenomena of "double descent", where more data leads to worse performance. This approach brings several key features to the ML community. Notably, the method naturally converges and removes the traditional need to divide the dataset into training, testing, and validation data. Instead, the selection metric inherently assesses testing error. This ensures that key information is never wasted in testing or validation.

Prostate cancer was the third most common cancer in 2020 internationally, coming after breast cancer and lung cancer. Furthermore, in recent years prostate cancer has shown an increasing trend. According to clinical experience, if this problem is detected and treated early, there can be a high chance of survival for the patient. One task that helps diagnose prostate cancer is prostate segmentation from magnetic resonance imaging. Manual segmentation performed by clinical experts has its drawbacks such as: the high time and concentration required from observers; and inter- and intra-observer variability. This is why in recent years automatic approaches to segment a prostate based on convolutional neural networks have emerged. Many of them have novel proposed architectures. In this paper I make an exhaustive study of several deep learning models by adjusting them to the task of prostate prediction. I do not use novel architectures, but focus my work more on how to train the networks. My approach is based on a ResNext101 3D encoder and a Unet3D decoder. I provide a study of the importance of resolutions in resampling data, something that no one else has done before.

Decentralized optimization with orthogonality constraints is found widely in scientific computing and data science. Since the orthogonality constraints are nonconvex, it is quite challenging to design efficient algorithms. Existing approaches leverage the geometric tools from Riemannian optimization to solve this problem at the cost of high sample and communication complexities. To relieve this difficulty, based on two novel techniques that can waive the orthogonality constraints, we propose a variance-reduced stochastic gradient tracking (VRSGT) algorithm with the convergence rate of $O(1 / k)$ to a stationary point. To the best of our knowledge, VRSGT is the first algorithm for decentralized optimization with orthogonality constraints that reduces both sampling and communication complexities simultaneously. In the numerical experiments, VRSGT has a promising performance in a real-world autonomous driving application.

Context: The number of TV series offered nowadays is very high. Due to its large amount, many series are canceled due to a lack of originality that generates a low audience. Problem: Having a decision support system that can show why some shows are a huge success or not would facilitate the choices of renewing or starting a show. Solution: We studied the case of the series Arrow broadcasted by CW Network and used descriptive and predictive modeling techniques to predict the IMDb rating. We assumed that the theme of the episode would affect its evaluation by users, so the dataset is composed only by the director of the episode, the number of reviews that episode got, the percentual of each theme extracted by the Latent Dirichlet Allocation (LDA) model of an episode, the number of viewers from Wikipedia and the rating from IMDb. The LDA model is a generative probabilistic model of a collection of documents made up of words. Method: In this prescriptive research, the case study method was used, and its results were analyzed using a quantitative approach. Summary of Results: With the features of each episode, the model that performed the best to predict the rating was Catboost due to a similar mean squared error of the KNN model but a better standard deviation during the test phase. It was possible to predict IMDb ratings with an acceptable root mean squared error of 0.55.

Many machine learning problems use data in the tabular domains. Adversarial examples can be especially damaging for these applications. Yet, existing works on adversarial robustness mainly focus on machine-learning models in the image and text domains. We argue that due to the differences between tabular data and images or text, existing threat models are inappropriate for tabular domains. These models do not capture that cost can be more important than imperceptibility, nor that the adversary could ascribe different value to the utility obtained from deploying different adversarial examples. We show that due to these differences the attack and defence methods used for images and text cannot be directly applied to the tabular setup. We address these issues by proposing new cost and utility-aware threat models tailored to the adversarial capabilities and constraints of attackers targeting tabular domains. We introduce a framework that enables us to design attack and defence mechanisms which result in models protected against cost or utility-aware adversaries, e.g., adversaries constrained by a certain dollar budget. We show that our approach is effective on three tabular datasets corresponding to applications for which adversarial examples can have economic and social implications.

DeepLearningsystemsneedlargedatafortraining.Datasets for training face verification systems are difficult to obtain and prone to privacy issues. Synthetic data generated by generative models such as GANs can be a good alternative. However, we show that data generated from GANs are prone to bias and fairness issues. Specifically GANs trained on FFHQ dataset show bias towards generating white faces in the age group of 20-29. We also demonstrate that synthetic faces cause disparate impact, specifically for race attribute, when used for fine tuning face verification systems. This is measured using $DoB_{fv}$ metric, which is defined as standard deviation of GAR@FAR for face verification.

A novel deep neural network (DNN) architecture is proposed wherein the filtering and linear transform are realized solely with product quantization (PQ). This results in a natural implementation via content addressable memory (CAM), which transcends regular DNN layer operations and requires only simple table lookup. Two schemes are developed for the end-to-end PQ prototype training, namely, through angle- and distance-based similarities, which differ in their multiplicative and additive natures with different complexity-accuracy tradeoffs. Even more, the distance-based scheme constitutes a truly multiplier-free DNN solution. Experiments confirm the feasibility of such Product-Quantized Content Addressable Memory Network (PECAN), which has strong implication on hardware-efficient deployments especially for in-memory computing.

Cardiovascular disease, the leading cause of death globally, is an age-related disease. Understanding the morphological and functional changes of the heart during ageing is a key scientific question, the answer to which will help us define important risk factors of cardiovascular disease and monitor disease progression. In this work, we propose a novel conditional generative model to describe the changes of 3D anatomy of the heart during ageing. The proposed model is flexible and allows integration of multiple clinical factors (e.g. age, gender) into the generating process. We train the model on a large-scale cross-sectional dataset of cardiac anatomies and evaluate on both cross-sectional and longitudinal datasets. The model demonstrates excellent performance in predicting the longitudinal evolution of the ageing heart and modelling its data distribution.

This paper is a survey of methods for solving smooth (strongly) monotone stochastic variational inequalities. To begin with, we give the deterministic foundation from which the stochastic methods eventually evolved. Then we review methods for the general stochastic formulation, and look at the finite sum setup. The last parts of the paper are devoted to various recent (not necessarily stochastic) advances in algorithms for variational inequalities.

Recent developments for Semi-Supervised Object Detection (SSOD) have shown the promise of leveraging unlabeled data to improve an object detector. However, thus far these methods have assumed that the unlabeled data does not contain out-of-distribution (OOD) classes, which is unrealistic with larger-scale unlabeled datasets. In this paper, we consider a more practical yet challenging problem, Open-Set Semi-Supervised Object Detection (OSSOD). We first find the existing SSOD method obtains a lower performance gain in open-set conditions, and this is caused by the semantic expansion, where the distracting OOD objects are mispredicted as in-distribution pseudo-labels for the semi-supervised training. To address this problem, we consider online and offline OOD detection modules, which are integrated with SSOD methods. With the extensive studies, we found that leveraging an offline OOD detector based on a self-supervised vision transformer performs favorably against online OOD detectors due to its robustness to the interference of pseudo-labeling. In the experiment, our proposed framework effectively addresses the semantic expansion issue and shows consistent improvements on many OSSOD benchmarks, including large-scale COCO-OpenImages. We also verify the effectiveness of our framework under different OSSOD conditions, including varying numbers of in-distribution classes, different degrees of supervision, and different combinations of unlabeled sets.

Reliable outlier detection is critical for real-world applications of deep learning models. Likelihoods produced by deep generative models, although extensively studied, have been largely dismissed as being impractical for outlier detection. For one, deep generative model likelihoods are readily biased by low-level input statistics. Second, many recent solutions for correcting these biases are computationally expensive or do not generalize well to complex, natural datasets. Here, we explore outlier detection with a state-of-the-art deep autoregressive model: PixelCNN++. We show that biases in PixelCNN++ likelihoods arise primarily from predictions based on local dependencies. We propose two families of bijective transformations that we term "shaking" and "stirring", which ameliorate low-level biases and isolate the contribution of long-range dependencies to the PixelCNN++ likelihood. These transformations are computationally inexpensive and readily applied at evaluation time. We evaluate our approaches extensively with five grayscale and six natural image datasets and show that they achieve or exceed state-of-the-art outlier detection performance. In sum, lightweight remedies suffice to achieve robust outlier detection on images with deep generative models.

In this study, a radiomics approach was extended to optical fluorescence molecular imaging data for tissue classification, termed 'optomics'. Fluorescence molecular imaging is emerging for precise surgical guidance during head and neck squamous cell carcinoma (HNSCC) resection. However, the tumor-to-normal tissue contrast is confounded by intrinsic physiological limitations of heterogeneous expression of the target molecule, epidermal growth factor receptor (EGFR). Optomics seek to improve tumor identification by probing textural pattern differences in EGFR expression conveyed by fluorescence. A total of 1,472 standardized optomic features were extracted from fluorescence image samples. A supervised machine learning pipeline involving a support vector machine classifier was trained with 25 top-ranked features selected by minimum redundancy maximum relevance criterion. Model predictive performance was compared to fluorescence intensity thresholding method by classifying testing set image patches of resected tissue with histologically confirmed malignancy status. The optomics approach provided consistent improvement in prediction accuracy on all test set samples, irrespective of dose, compared to fluorescence intensity thresholding method (mean accuracies of 89% vs. 81%; P = 0.0072). The improved performance demonstrates that extending the radiomics approach to fluorescence molecular imaging data offers a promising image analysis technique for cancer detection in fluorescence-guided surgery.

Customer Life Time Value (LTV) is the expected total revenue that a single user can bring to a business. It is widely used in a variety of business scenarios to make operational decisions when acquiring new customers. Modeling LTV is a challenging problem, due to its complex and mutable data distribution. Existing approaches either directly learn from posterior feature distributions or leverage statistical models that make strong assumption on prior distributions, both of which fail to capture those mutable distributions. In this paper, we propose a complete set of industrial-level LTV modeling solutions. Specifically, we introduce an Order Dependency Monotonic Network (ODMN) that models the ordered dependencies between LTVs of different time spans, which greatly improves model performance. We further introduce a Multi Distribution Multi Experts (MDME) module based on the Divide-and-Conquer idea, which transforms the severely imbalanced distribution modeling problem into a series of relatively balanced sub-distribution modeling problems hence greatly reduces the modeling complexity. In addition, a novel evaluation metric Mutual Gini is introduced to better measure the distribution difference between the estimated value and the ground-truth label based on the Lorenz Curve. The ODMN framework has been successfully deployed in many business scenarios of Kuaishou, and achieved great performance. Extensive experiments on real-world industrial data demonstrate the superiority of the proposed methods compared to state-of-the-art baselines including ZILN and Two-Stage XGBoost models.

We study the application of the factor graph framework for symbol detection on linear inter-symbol interference channels. Cyclic factor graphs have the potential to yield low-complexity symbol detectors, but are suboptimal if the ubiquitous sum-product algorithm is applied. In this paper, we present and evaluate strategies to improve the performance of cyclic factor graph-based symbol detection algorithms by means of neural enhancement. In particular, we apply neural belief propagation as an effective way to counteract the effect of cycles within the factor graph. We further propose the application and optimization of a linear preprocessor of the channel output. By modifying the observation model, the preprocessing can effectively change the underlying factor graph, thereby significantly improving the detection performance as well as reducing the complexity.

Fine-tuning can be vulnerable to adversarial attacks. Existing works about black-box attacks on fine-tuned models (BAFT) are limited by strong assumptions. To fill the gap, we propose two novel BAFT settings, cross-domain and cross-domain cross-architecture BAFT, which only assume that (1) the target model for attacking is a fine-tuned model, and (2) the source domain data is known and accessible. To successfully attack fine-tuned models under both settings, we propose to first train an adversarial generator against the source model, which adopts an encoder-decoder architecture and maps a clean input to an adversarial example. Then we search in the low-dimensional latent space produced by the encoder of the adversarial generator. The search is conducted under the guidance of the surrogate gradient obtained from the source model. Experimental results on different domains and different network architectures demonstrate that the proposed attack method can effectively and efficiently attack the fine-tuned models.

Federated learning is a popular strategy for training models on distributed, sensitive data, while preserving data privacy. Prior work identified a range of security threats on federated learning protocols that poison the data or the model. However, federated learning is a networked system where the communication between clients and server plays a critical role for the learning task performance. We highlight how communication introduces another vulnerability surface in federated learning and study the impact of network-level adversaries on training federated learning models. We show that attackers dropping the network traffic from carefully selected clients can significantly decrease model accuracy on a target population. Moreover, we show that a coordinated poisoning campaign from a few clients can amplify the dropping attacks. Finally, we develop a server-side defense which mitigates the impact of our attacks by identifying and up-sampling clients likely to positively contribute towards target accuracy. We comprehensively evaluate our attacks and defenses on three datasets, assuming encrypted communication channels and attackers with partial visibility of the network.

Multi-view learning has progressed rapidly in recent years. Although many previous studies assume that each instance appears in all views, it is common in real-world applications for instances to be missing from some views, resulting in incomplete multi-view data. To tackle this problem, we propose a novel Latent Heterogeneous Graph Network (LHGN) for incomplete multi-view learning, which aims to use multiple incomplete views as fully as possible in a flexible manner. By learning a unified latent representation, a trade-off between consistency and complementarity among different views is implicitly realized. To explore the complex relationship between samples and latent representations, a neighborhood constraint and a view-existence constraint are proposed, for the first time, to construct a heterogeneous graph. Finally, to avoid any inconsistencies between training and test phase, a transductive learning technique is applied based on graph learning for classification tasks. Extensive experimental results on real-world datasets demonstrate the effectiveness of our model over existing state-of-the-art approaches.

The liver is one of the most critical metabolic organs in vertebrates due to its vital functions in the human body, such as detoxification of the blood from waste products and medications. Liver diseases due to liver tumors are one of the most common mortality reasons around the globe. Hence, detecting liver tumors in the early stages of tumor development is highly required as a critical part of medical treatment. Many imaging modalities can be used as aiding tools to detect liver tumors. Computed tomography (CT) is the most used imaging modality for soft tissue organs such as the liver. This is because it is an invasive modality that can be captured relatively quickly. This paper proposed an efficient automatic liver segmentation framework to detect and segment the liver out of CT abdomen scans using the 3D CNN DeepMedic network model. Segmenting the liver region accurately and then using the segmented liver region as input to tumors segmentation method is adopted by many studies as it reduces the false rates resulted from segmenting abdomen organs as tumors. The proposed 3D CNN DeepMedic model has two pathways of input rather than one pathway, as in the original 3D CNN model. In this paper, the network was supplied with multiple abdomen CT versions, which helped improve the segmentation quality. The proposed model achieved 94.36%, 94.57%, 91.86%, and 93.14% for accuracy, sensitivity, specificity, and Dice similarity score, respectively. The experimental results indicate the applicability of the proposed method.

Deep learning has been widely applied in neuroimaging, including to predicting brain-phenotype relationships from magnetic resonance imaging (MRI) volumes. MRI data usually requires extensive preprocessing before it is ready for modeling, even via deep learning, in part due to its high dimensionality and heterogeneity. A growing array of MRI preprocessing pipelines have been developed each with its own strengths and limitations. Recent studies have shown that pipeline-related variation may lead to different scientific findings, even when using the identical data. Meanwhile, the machine learning community has emphasized the importance of shifting from model-centric to data-centric approaches given that data quality plays an essential role in deep learning applications. Motivated by this idea, we first evaluate how preprocessing pipeline selection can impact the downstream performance of a supervised learning model. We next propose two pipeline-invariant representation learning methodologies, MPSL and PXL, to improve consistency in classification performance and to capture similar neural network representations between pipeline pairs. Using 2000 human subjects from the UK Biobank dataset, we demonstrate that both models present unique advantages, in particular that MPSL can be used to improve out-of-sample generalization to new pipelines, while PXL can be used to improve predictive performance consistency and representational similarity within a closed pipeline set. These results suggest that our proposed models can be applied to overcome pipeline-related biases and to improve reproducibility in neuroimaging prediction tasks.

A relational dataset is often analyzed by optimally assigning a label to each element through clustering or ordering. While similar characterizations of a dataset would be achieved by both clustering and ordering methods, the former has been studied much more actively than the latter, particularly for the data represented as graphs. This study fills this gap by investigating methodological relationships between several clustering and ordering methods, focusing on spectral techniques. Furthermore, we evaluate the resulting performance of the clustering and ordering methods. To this end, we propose a measure called the label continuity error, which generically quantifies the degree of consistency between a sequence and partition for a set of elements. Based on synthetic and real-world datasets, we evaluate the extents to which an ordering method identifies a module structure and a clustering method identifies a banded structure.

Vision and Language Pretraining has become the prevalent approach for tackling multimodal downstream tasks. The current trend is to move towards ever larger models and pretraining datasets. This computational headlong rush does not seem reasonable in the long term to move toward sustainable solutions, and de facto excludes academic laboratories with limited resources. In this work, we propose a new framework, dubbed ViCHA, that efficiently exploits the input data to boost the learning by: (a) a new hierarchical cross-modal alignment loss, (b) new self-supervised scheme based on masked image modeling, (c) leveraging image-level annotations, called Visual Concepts, obtained with existing foundation models such as CLIP to boost the performance of the image encoder. Although pretrained on four times less data, our ViCHA strategy outperforms other approaches on several downstream tasks such as Image-Text Retrieval, VQA, Visual Reasoning, Visual Entailment and Visual Grounding. The code will be made publicly available here: https://github.com/mshukor/ViCHA

Satellite images constitute a highly valuable and abundant resource for many real world applications. However, the labeled data needed to train most machine learning models are scarce and difficult to obtain. In this context, the current work investigates a fully unsupervised methodology that, given a temporal sequence of satellite images, creates a partition of the ground according to its semantic properties and their evolution over time. The sequences of images are translated into a grid of multivariate time series of embedded tiles. The embedding and the partitional clustering of these sequences of tiles are constructed in two iterative steps: In the first step, the embedding is able to extract the information of the sequences of tiles based on a geographical neighborhood, and the tiles are grouped into clusters. In the second step, the embedding is refined by using the neighborhood defined by the clusters, and the final clustering of the sequences of tiles is obtained. We illustrate the methodology by conducting the semantic clustering of a sequence of 20 satellite images of the region of Navarra (Spain). The results show that the clustering of multivariate time series is robust and contains trustful spatio-temporal semantic information about the region under study. We unveil the close connection that exists between the geographic and embedded spaces, and find out that the semantic properties attributed to these kinds of embeddings are fully exploited and even enhanced by the proposed clustering of time series.

Overparameterized models with millions of parameters have been hugely successful. In this work, we ask: can the need for large models be, at least in part, due to the \emph{computational} limitations of the learner? Additionally, we ask, is this situation exacerbated for \emph{robust} learning? We show that this indeed could be the case. We show learning tasks for which computationally bounded learners need \emph{significantly more} model parameters than what information-theoretic learners need. Furthermore, we show that even more model parameters could be necessary for robust learning. In particular, for computationally bounded learners, we extend the recent result of Bubeck and Sellke [NeurIPS'2021] which shows that robust models might need more parameters, to the computational regime and show that bounded learners could provably need an even larger number of parameters. Then, we address the following related question: can we hope to remedy the situation for robust computationally bounded learning by restricting \emph{adversaries} to also be computationally bounded for sake of obtaining models with fewer parameters? Here again, we show that this could be possible. Specifically, building on the work of Garg, Jha, Mahloujifar, and Mahmoody [ALT'2020], we demonstrate a learning task that can be learned efficiently and robustly against a computationally bounded attacker, while to be robust against an information-theoretic attacker requires the learner to utilize significantly more parameters.

Performance metrics measuring in Financial Integrity systems are crucial for maintaining an efficient and cost effective operation. An important performance metric is False Positive Rate. This metric cannot be directly monitored since we don't know for sure if a user is bad once blocked. We present a statistical method based on survey theory and causal inference methods to estimate the false positive rate of the system or a single blocking policy. We also suggest a new approach of outcome matching that in some cases including empirical data outperformed other commonly used methods. The approaches described in this paper can be applied in other Integrity domains such as Cyber Security.

Deep neural network, despite its remarkable capability of discriminating targeted in-distribution samples, shows poor performance on detecting anomalous out-of-distribution data. To address this defect, state-of-the-art solutions choose to train deep networks on an auxiliary dataset of outliers. Various training criteria for these auxiliary outliers are proposed based on heuristic intuitions. However, we find that these intuitively designed outlier training criteria can hurt in-distribution learning and eventually lead to inferior performance. To this end, we identify three causes of the in-distribution incompatibility: contradictory gradient, false likelihood, and distribution shift. Based on our new understandings, we propose a new out-of-distribution detection method by adapting both the top-design of deep models and the loss function. Our method achieves in-distribution compatibility by pursuing less interference with the probabilistic characteristic of in-distribution features. On several benchmarks, our method not only achieves the state-of-the-art out-of-distribution detection performance but also improves the in-distribution accuracy.

A novel method for access control with a secret key is proposed to protect models from unauthorized access in this paper. We focus on semantic segmentation models with the vision transformer (ViT), called segmentation transformer (SETR). Most existing access control methods focus on image classification tasks, or they are limited to CNNs. By using a patch embedding structure that ViT has, trained models and test images can be efficiently encrypted with a secret key, and then semantic segmentation tasks are carried out in the encrypted domain. In an experiment, the method is confirmed to provide the same accuracy as that of using plain images without any encryption to authorized users with a correct key and also to provide an extremely degraded accuracy to unauthorized users.

In the context of distributed deep learning, the issue of stale weights or gradients could result in poor algorithmic performance. This issue is usually tackled by delay tolerant algorithms with some mild assumptions on the objective functions and step sizes. In this paper, we propose a different approach to develop a new algorithm, called $\textbf{P}$redicting $\textbf{C}$lipping $\textbf{A}$synchronous $\textbf{S}$tochastic $\textbf{G}$radient $\textbf{D}$escent (aka, PC-ASGD). Specifically, PC-ASGD has two steps - the $\textit{predicting step}$ leverages the gradient prediction using Taylor expansion to reduce the staleness of the outdated weights while the $\textit{clipping step}$ selectively drops the outdated weights to alleviate their negative effects. A tradeoff parameter is introduced to balance the effects between these two steps. Theoretically, we present the convergence rate considering the effects of delay of the proposed algorithm with constant step size when the smooth objective functions are weakly strongly-convex and nonconvex. One practical variant of PC-ASGD is also proposed by adopting a condition to help with the determination of the tradeoff parameter. For empirical validation, we demonstrate the performance of the algorithm with two deep neural network architectures on two benchmark datasets.

Activation functions are essential for neural networks to introduce non-linearity. A great number of empirical experiments have validated various activation functions, yet theoretical research on activation functions are insufficient. In this work, we study the impact of activation functions on the variance of gradients and propose an approach to normalize activation functions to keep the variance of the gradient same for all layers so that the neural network can achieve better convergence. First, we complement the previous work on the analysis of the variance of gradients where the impact of activation functions are just considered in an idealized initial state which almost cannot be preserved during training and obtained a property that good activation functions should satisfy as possible. Second, we offer an approach to normalize activation functions and testify its effectiveness on prevalent activation functions empirically. And by observing experiments, we discover that the speed of convergence is roughly related to the property we derived in the former part. We run experiments of our normalized activation functions against common activation functions. And the result shows our approach consistently outperforms their unnormalized counterparts. For example, normalized Swish outperforms vanilla Swish by 1.2% on ResNet50 with CIFAR-100 in terms of top-1 accuracy. Our method improves the performance by simply replacing activation functions with their normalized ones in both fully-connected networks and residual networks.

Recently machine learning techniques have become popular for analysing physical systems and solving problems occurring in quantum computing. In this paper we focus on using such techniques for finding the sequence of physical operations implementing the given quantum logical operation. In this context we analyse the flexibility of the data representation and compare the applicability of two machine learning approaches based on different representations of data. We demonstrate that the utilization of the geometrical structure of control pulses is sufficient for achieving high-fidelity of the implemented evolution. We also demonstrate that artificial neural networks, unlike geometrical methods, posses the generalization abilities enabling them to generate control pulses for the systems with variable strength of the disturbance. The presented results suggest that in some quantum control scenarios, geometrical data representation and processing is competitive to more complex methods.

Taiwan has the highest susceptibility to and fatalities from debris flows worldwide. The existing debris flow warning system in Taiwan, which uses a time-weighted measure of rainfall, leads to alerts when the measure exceeds a predefined threshold. However, this system generates many false alarms and misses a substantial fraction of the actual debris flows. Towards improving this system, we implemented five machine learning models that input historical rainfall data and predict whether a debris flow will occur within a selected time. We found that a random forest model performed the best among the five models and outperformed the existing system in Taiwan. Furthermore, we identified the rainfall trajectories strongly related to debris flow occurrences and explored trade-offs between the risks of missing debris flows versus frequent false alerts. These results suggest the potential for machine learning models trained on hourly rainfall data alone to save lives while reducing false alerts.

We introduce a method to identify speakers by computing with high-dimensional random vectors. Its strengths are simplicity and speed. With only 1.02k active parameters and a 128-minute pass through the training data we achieve Top-1 and Top-5 scores of 31% and 52% on the VoxCeleb1 dataset of 1,251 speakers. This is in contrast to CNN models requiring several million parameters and orders of magnitude higher computational complexity for only a 2$\times$ gain in discriminative power as measured in mutual information. An additional 92 seconds of training with Generalized Learning Vector Quantization (GLVQ) raises the scores to 48% and 67%. A trained classifier classifies 1 second of speech in 5.7 ms. All processing was done on standard CPU-based machines.

After the development of different machine learning and manifold learning algorithms, it may be a good time to put them together to make a powerful mind for machine. In this work, we propose affective manifolds as components of a machine's mind. Every affective manifold models a characteristic group of mind and contains multiple states. We define the machine's mind as a set of affective manifolds. We use a learning model for mapping the input signals to the embedding space of affective manifold. Using this mapping, a machine or a robot takes an input signal and can react emotionally to it. We use deep metric learning, with Siamese network, and propose a loss function for affective manifold learning. We define margins between states based on the psychological and philosophical studies. Using triplets of instances, we train the network to minimize the variance of every state and have the desired distances between states. We show that affective manifolds can have various applications for machine-machine and human-machine interactions. Some simulations are also provided for verification of the proposed method. It is possible to have as many affective manifolds as required in machine's mind. More affective manifolds in the machine's mind can make it more realistic and effective. This paper opens the door; we invite the researchers from various fields of science to propose more affective manifolds to be inserted in machine's mind.

This paper deals with the design of nonlinear MPC controllers that provide offset-free setpoint tracking for models described by Neural Nonlinear AutoRegressive eXogenous (NNARX) networks. The NNARX model is identified from input-output data collected from the plant, and can be given a state-space representation with known measurable states made by past input and output variables, so that a state observer is not required. In the training phase, the Incremental Input-to-State Stability ({\delta}ISS) property can be forced when consistent with the behavior of the plant. The {\delta}ISS property is then leveraged to augment the model with an explicit integral action on the output tracking error, which allows to achieve offset-free tracking capabilities to the designed control scheme. The proposed control architecture is numerically tested on a water heating system and the achieved results are compared to those scored by another popular offset-free MPC method, showing that the proposed scheme attains remarkable performances even in presence of disturbances acting on the plant.

Analyzing geometric properties of high-dimensional loss functions, such as local curvature and the existence of other optima around a certain point in loss space, can help provide a better understanding of the interplay between neural network structure, implementation attributes, and learning performance. In this work, we combine concepts from high-dimensional probability and differential geometry to study how curvature properties in lower-dimensional loss representations depend on those in the original loss space. We show that saddle points in the original space are rarely correctly identified as such in lower-dimensional representations if random projections are used. In such projections, the expected curvature in a lower-dimensional representation is proportional to the mean curvature in the original loss space. Hence, the mean curvature in the original loss space determines if saddle points appear, on average, as either minima, maxima, or almost flat regions. We use the connection between expected curvature and mean curvature (i.e., the normalized Hessian trace) to estimate the trace of Hessians without calculating the Hessian or Hessian-vector products as in Hutchinson's method. Because random projections are not able to correctly identify saddle information, we propose to study projections along Hessian directions that are associated with the largest and smallest principal curvatures. We connect our findings to the ongoing debate on loss landscape flatness and generalizability. Finally, we illustrate our method in numerical experiments on different image classifiers with up to about $7\times 10^6$ parameters.

At the age of big data, recommender systems have shown remarkable success as a key means of information filtering in our daily life. Recent years have witnessed the technical development of recommender systems, from perception learning to cognition reasoning which intuitively build the task of recommendation as the procedure of logical reasoning and have achieve significant improvement. However, the logical statement in reasoning implicitly admits irrelevance of ordering, even does not consider time information which plays an important role in many recommendation tasks. Furthermore, recommendation model incorporated with temporal context would tend to be self-attentive, i.e., automatically focus more (less) on the relevance (irrelevance), respectively. To address these issues, in this paper, we propose a Time-aware Self-Attention with Neural Collaborative Reasoning (TiSANCR) based recommendation model, which integrates temporal patterns and self-attention mechanism into reasoning-based recommendation. Specially, temporal patterns represented by relative time, provide context and auxiliary information to characterize the user's preference in recommendation, while self-attention is leveraged to distill informative patterns and suppress irrelevances. Therefore, the fusion of self-attentive temporal information provides deeper representation of user's preference. Extensive experiments on benchmark datasets demonstrate that the proposed TiSANCR achieves significant improvement and consistently outperforms the state-of-the-art recommendation methods.

For companies with customer service, mapping intents inside their conversational data is crucial in building applications based on natural language understanding (NLU). Nevertheless, there is no established automated technique to gather the intents from noisy online chats or voice transcripts. Simple clustering approaches are not suited to intent-sparse dialogues. To solve this intent-landscape task, we propose an unsupervised pipeline that extracts the intents and the taxonomy of intents from real-world dialogues. Our pipeline mines intent-span candidates with an extractive Question-Answering Electra model and leverages sentence embeddings to apply a low-level density clustering followed by a top-level hierarchical clustering. Our results demonstrate the generalization ability of an ELECTRA large model fine-tuned on the SQuAD2 dataset to understand dialogues. With the right prompting question, this model achieves a rate of linguistic validation on intent spans beyond 85%. We furthermore reconstructed the intent schemes of five domains from the MultiDoGo dataset with an average recall of 94.3%.

Deep neural networks (DNNs) have been shown to outperform traditional machine learning algorithms in a broad variety of application domains due to their effectiveness in modeling intricate problems and handling high-dimensional datasets. Many real-life datasets, however, are of increasingly high dimensionality, where a large number of features may be irrelevant to the task at hand. The inclusion of such features would not only introduce unwanted noise but also increase computational complexity. Furthermore, due to high non-linearity and dependency among a large number of features, DNN models tend to be unavoidably opaque and perceived as black-box methods because of their not well-understood internal functioning. A well-interpretable model can identify statistically significant features and explain the way they affect the model's outcome. In this paper, we propose an efficient method to improve the interpretability of black-box models for classification tasks in the case of high-dimensional datasets. To this end, we first train a black-box model on a high-dimensional dataset to learn the embeddings on which the classification is performed. To decompose the inner working principles of the black-box model and to identify top-k important features, we employ different probing and perturbing techniques. We then approximate the behavior of the black-box model by means of an interpretable surrogate model on the top-k feature space. Finally, we derive decision rules and local explanations from the surrogate model to explain individual decisions. Our approach outperforms and competes with state-of-the-art methods such as TabNet, XGboost, and SHAP-based interpretability techniques when tested on different datasets with varying dimensionality between 50 and 20,000.

Domain adaptation is a popular paradigm in modern machine learning which aims at tackling the problem of divergence between training or validation dataset possessing labels for learning and testing a classifier (source domain) and a potentially large unlabeled dataset where the model is exploited (target domain). The task is to find such a common representation of both source and target datasets in which the source dataset is informative for training and such that the divergence between source and target would be minimized. Most popular solutions for domain adaptation are currently based on training neural networks that combine classification and adversarial learning modules, which are data hungry and usually difficult to train. We present a method called Domain Adaptation Principal Component Analysis (DAPCA) which finds a linear reduced data representation useful for solving the domain adaptation task. DAPCA is based on introducing positive and negative weights between pairs of data points and generalizes the supervised extension of principal component analysis. DAPCA represents an iterative algorithm such that at each iteration a simple quadratic optimization problem is solved. The convergence of the algorithm is guaranteed and the number of iterations is small in practice. We validate the suggested algorithm on previously proposed benchmarks for solving the domain adaptation task, and also show the benefit of using DAPCA in the analysis of single cell omics datasets in biomedical applications. Overall, DAPCA can serve as a useful preprocessing step in many machine learning applications leading to reduced dataset representations, taking into account possible divergence between source and target domains.

Partial-label learning is a kind of weakly-supervised learning with inexact labels, where for each training example, we are given a set of candidate labels instead of only one true label. Recently, various approaches on partial-label learning have been proposed under different generation models of candidate label sets. However, these methods require relatively strong distributional assumptions on the generation models. When the assumptions do not hold, the performance of the methods is not guaranteed theoretically. In this paper, we propose the notion of properness on partial labels. We show that this proper partial-label learning framework requires a weaker distributional assumption and includes many previous partial-label learning settings as special cases. We then derive a unified unbiased estimator of the classification risk. We prove that our estimator is risk-consistent, and we also establish an estimation error bound. Finally, we validate the effectiveness of our algorithm through experiments.

A railway is a complex system comprising multiple infrastructure and rolling stock assets. To operate the system safely, reliably, and efficiently, the condition many components needs to be monitored. To automate this process, data-driven fault detection and diagnostics models can be employed. In practice, however, the performance of data-driven models can be compromised if the training dataset is not representative of all possible future conditions. We propose to approach this problem by learning a feature representation that is, on the one hand, invariant to operating or environmental factors but, on the other hand, sensitive to changes in the asset's health condition. We evaluate how contrastive learning can be employed on supervised and unsupervised fault detection and diagnostics tasks given real condition monitoring datasets within a railway system - one image dataset from infrastructure assets and one time-series dataset from rolling stock assets. First, we evaluate the performance of supervised contrastive feature learning on a railway sleeper defect classification task given a labeled image dataset. Second, we evaluate the performance of unsupervised contrastive feature learning without access to faulty samples on an anomaly detection task given a railway wheel dataset. Here, we test the hypothesis of whether a feature encoder's sensitivity to degradation is also sensitive to novel fault patterns in the data. Our results demonstrate that contrastive feature learning improves the performance on the supervised classification task regarding sleepers compared to a state-of-the-art method. Moreover, on the anomaly detection task concerning the railway wheels, the detection of shelling defects is improved compared to state-of-the-art methods.

In this paper, we present novel variations of an earlier approach called homogeneous clustering algorithm for reducing dataset size. The intuition behind the approaches proposed in this paper is to partition the dataset into homogeneous clusters and select some images which contribute significantly to the accuracy. Selected images are the proper subset of the training data and thus are human-readable. We propose four variations upon the baseline algorithm-RHC. The intuition behind the first approach, RHCKON, is that the boundary points contribute significantly towards the representation of clusters. It involves selecting k farthest and one nearest neighbour of the centroid of the clusters. In the following two approaches (KONCW and CWKC), we introduce the concept of cluster weights. They are based on the fact that larger clusters contribute more than smaller sized clusters. The final variation is GHCIDR which selects points based on the geometrical aspect of data distribution. We performed the experiments on two deep learning models- Fully Connected Networks (FCN) and VGG1. We experimented with the four variants on three datasets- MNIST, CIFAR10, and Fashion-MNIST. We found that GHCIDR gave the best accuracy of 99.35%, 81.10%, and 91.66% and a training data reduction of 87.27%, 32.34%, and 76.80% on MNIST, CIFAR10, and Fashion-MNIST respectively.

We propose a new hybrid system for automatically generating and training quantum-inspired classifiers on grayscale images by using multiobjective genetic algorithms. We define a dynamic fitness function to obtain the smallest possible circuit and highest accuracy on unseen data, ensuring that the proposed technique is generalizable and robust. We minimize the complexity of the generated circuits in terms of the number of entanglement gates by penalizing their appearance. We reduce the size of the images with two dimensionality reduction approaches: principal component analysis (PCA), which is encoded in the individual for optimization purpose, and a small convolutional autoencoder (CAE). These two methods are compared with one another and with a classical nonlinear approach to understand their behaviors and to ensure that the classification ability is due to the quantum circuit and not the preprocessing technique used for dimensionality reduction.

This study proposes an end-to-end unsupervised diffeomorphic deformable registration framework based on moving mesh parameterization. Using this parameterization, a deformation field can be modeled with its transformation Jacobian determinant and curl of end velocity field. The new model of the deformation field has three important advantages; firstly, it relaxes the need for an explicit regularization term and the corresponding weight in the cost function. The smoothness is implicitly embedded in the solution which results in a physically plausible deformation field. Secondly, it guarantees diffeomorphism through explicit constraints applied to the transformation Jacobian determinant to keep it positive. Finally, it is suitable for cardiac data processing, since the nature of this parameterization is to define the deformation field in terms of the radial and rotational components. The effectiveness of the algorithm is investigated by evaluating the proposed method on three different data sets including 2D and 3D cardiac MRI scans. The results demonstrate that the proposed framework outperforms existing learning-based and non-learning-based methods while generating diffeomorphic transformations.

Learning heterogeneous graphs consisting of different types of nodes and edges enhances the results of homogeneous graph techniques. An interesting example of such graphs is control-flow graphs representing possible software code execution flows. As such graphs represent more semantic information of code, developing techniques and tools for such graphs can be highly beneficial for detecting vulnerabilities in software for its reliability. However, existing heterogeneous graph techniques are still insufficient in handling complex graphs where the number of different types of nodes and edges is large and variable. This paper concentrates on the Ethereum smart contracts as a sample of software codes represented by heterogeneous contract graphs built upon both control-flow graphs and call graphs containing different types of nodes and links. We propose MANDO, a new heterogeneous graph representation to learn such heterogeneous contract graphs' structures. MANDO extracts customized metapaths, which compose relational connections between different types of nodes and their neighbors. Moreover, it develops a multi-metapath heterogeneous graph attention network to learn multi-level embeddings of different types of nodes and their metapaths in the heterogeneous contract graphs, which can capture the code semantics of smart contracts more accurately and facilitate both fine-grained line-level and coarse-grained contract-level vulnerability detection. Our extensive evaluation of large smart contract datasets shows that MANDO improves the vulnerability detection results of other techniques at the coarse-grained contract level. More importantly, it is the first learning-based approach capable of identifying vulnerabilities at the fine-grained line-level, and significantly improves the traditional code analysis-based vulnerability detection approaches by 11.35% to 70.81% in terms of F1-score.

In this paper, we propose a novel nonlinear observer, called the neural observer, for observation tasks of linear time-invariant (LTI) systems and uncertain nonlinear systems by introducing the neural network (NN) into the design of observers. By exploring the method of NN representation to the NN mapping vector, we derive stability analyses (e.g., exponential convergence rate) of LTI and uncertain nonlinear systems that pave the way to solve observation problems using linear matrix inequalities (LMIs) only. Remarkably, the neural observer designed for uncertain systems is based on the ideology of the active disturbance rejection control (ADRC), which can measure the uncertainty in real-time. The LMI results are also significant since we reveal that the observability and controllability of system matrices are required for the existence of solutions of LMIs. Finally, we verify the availability of neural observers on three simulation cases, including the X-29A aircraft model, the nonlinear pendulum, and the four-wheel steering vehicle.

Data-enabled cities are recently accelerated and enhanced with automated learning for improved Smart Cities applications. In the context of an Internet of Things (IoT) ecosystem, the data communication is frequently costly, inefficient, not scalable and lacks security. Federated Learning (FL) plays a pivotal role in providing privacy-preserving and communication efficient Machine Learning (ML) frameworks. In this paper we evaluate the feasibility of FL in the context of a Smart Cities Street Light Monitoring application. FL is evaluated against benchmarks of centralised and (fully) personalised machine learning techniques for the classification task of the lampposts operation. Incorporating FL in such a scenario shows minimal performance reduction in terms of the classification task, but huge improvements in the communication cost and the privacy preserving. These outcomes strengthen FL's viability and potential for IoT applications.

The popularity of automated machine learning (AutoML) tools in different domains has increased over the past few years. Machine learning (ML) practitioners use AutoML tools to automate and optimize the process of feature engineering, model training, and hyperparameter optimization and so on. Recent work performed qualitative studies on practitioners' experiences of using AutoML tools and compared different AutoML tools based on their performance and provided features, but none of the existing work studied the practices of using AutoML tools in real-world projects at a large scale. Therefore, we conducted an empirical study to understand how ML practitioners use AutoML tools in their projects. To this end, we examined the top 10 most used AutoML tools and their respective usages in a large number of open-source project repositories hosted on GitHub. The results of our study show 1) which AutoML tools are mostly used by ML practitioners and 2) the characteristics of the repositories that use these AutoML tools. Also, we identified the purpose of using AutoML tools (e.g. model parameter sampling, search space management, model evaluation/error-analysis, Data/ feature transformation, and data labeling) and the stages of the ML pipeline (e.g. feature engineering) where AutoML tools are used. Finally, we report how often AutoML tools are used together in the same source code files. We hope our results can help ML practitioners learn about different AutoML tools and their usages, so that they can pick the right tool for their purposes. Besides, AutoML tool developers can benefit from our findings to gain insight into the usages of their tools and improve their tools to better fit the users' usages and needs.

Data redundancy is ubiquitous in the inputs and intermediate results of Deep Neural Networks (DNN). It offers many significant opportunities for improving DNN performance and efficiency and has been explored in a large body of work. These studies have scattered in many venues across several years. The targets they focus on range from images to videos and texts, and the techniques they use to detect and exploit data redundancy also vary in many aspects. There is not yet a systematic examination and summary of the many efforts, making it difficult for researchers to get a comprehensive view of the prior work, the state of the art, differences and shared principles, and the areas and directions yet to explore. This article tries to fill the void. It surveys hundreds of recent papers on the topic, introduces a novel taxonomy to put the various techniques into a single categorization framework, offers a comprehensive description of the main methods used for exploiting data redundancy in improving multiple kinds of DNNs on data, and points out a set of research opportunities for future to explore.

In this work, we focus on the challenging task, neuro-disease classification, using functional magnetic resonance imaging (fMRI). In population graph-based disease analysis, graph convolutional neural networks (GCNs) have achieved remarkable success. However, these achievements are inseparable from abundant labeled data and sensitive to spurious signals. To improve fMRI representation learning and classification under a label-efficient setting, we propose a novel and theory-driven self-supervised learning (SSL) framework on GCNs, namely Graph CCA for Temporal self-supervised learning on fMRI analysis GATE. Concretely, it is demanding to design a suitable and effective SSL strategy to extract formation and robust features for fMRI. To this end, we investigate several new graph augmentation strategies from fMRI dynamic functional connectives (FC) for SSL training. Further, we leverage canonical-correlation analysis (CCA) on different temporal embeddings and present the theoretical implications. Consequently, this yields a novel two-step GCN learning procedure comprised of (i) SSL on an unlabeled fMRI population graph and (ii) fine-tuning on a small labeled fMRI dataset for a classification task. Our method is tested on two independent fMRI datasets, demonstrating superior performance on autism and dementia diagnosis.

This work proposes a Stochastic Variational Deep Kernel Learning method for the data-driven discovery of low-dimensional dynamical models from high-dimensional noisy data. The framework is composed of an encoder that compresses high-dimensional measurements into low-dimensional state variables, and a latent dynamical model for the state variables that predicts the system evolution over time. The training of the proposed model is carried out in an unsupervised manner, i.e., not relying on labeled data. Our learning method is evaluated on the motion of a pendulum -- a well studied baseline for nonlinear model identification and control with continuous states and control inputs -- measured via high-dimensional noisy RGB images. Results show that the method can effectively denoise measurements, learn compact state representations and latent dynamical models, as well as identify and quantify modeling uncertainties.

The electricity market clearing is usually implemented via an open-loop predict-then-optimize (O-PO) process: it first predicts the available power of renewable energy sources (RES) and the system reserve requirements; then, given the predictions, the markets are cleared via optimization models, i.e., unit commitment (UC) and economic dispatch (ED), to pursue the optimal electricity market economy. However, the market economy could suffer from the open-loop process because its predictions may be overly myopic to the optimizations, i.e., the predictions seek to improve the immediate statistical forecasting errors instead of the ultimate market economy. To this end, this paper proposes a closed-loop predict-and-optimize (C-PO) framework based on the tri-level mixed-integer programming, which trains economy-oriented predictors tailored for the market-clearing optimization to improve the ultimate market economy. Specifically, the upper level trains the economy-oriented RES and reserve predictors according to their induced market economy; the middle and lower levels, with given predictions, mimic the market-clearing process and feed the induced market economy results back to the upper level. The trained economy-oriented predictors are then embedded into the UC model, forming a prescriptive UC model that can simultaneously provide RES-reserve predictions and UC decisions with enhanced market economy. Numerical case studies on an IEEE 118-bus system illustrate potential economic and practical advantages of C-PO over O-PO, robust UC, and stochastic UC.

Extracting structured information from HTML documents is a long-studied problem with a broad range of applications, including knowledge base construction, faceted search, and personalized recommendation. Prior works rely on a few human-labeled web pages from each target website or thousands of human-labeled web pages from some seed websites to train a transferable extraction model that generalizes on unseen target websites. Noisy content, low site-level consistency, and lack of inter-annotator agreement make labeling web pages a time-consuming and expensive ordeal. We develop LEAST -- a Label-Efficient Self-Training method for Semi-Structured Web Documents to overcome these limitations. LEAST utilizes a few human-labeled pages to pseudo-annotate a large number of unlabeled web pages from the target vertical. It trains a transferable web-extraction model on both human-labeled and pseudo-labeled samples using self-training. To mitigate error propagation due to noisy training samples, LEAST re-weights each training sample based on its estimated label accuracy and incorporates it in training. To the best of our knowledge, this is the first work to propose end-to-end training for transferable web extraction models utilizing only a few human-labeled pages. Experiments on a large-scale public dataset show that using less than ten human-labeled pages from each seed website for training, a LEAST-trained model outperforms previous state-of-the-art by more than 26 average F1 points on unseen websites, reducing the number of human-labeled pages to achieve similar performance by more than 10x.

Stealthy hardware Trojans (HTs) inserted during the fabrication of integrated circuits can bypass the security of critical infrastructures. Although researchers have proposed many techniques to detect HTs, several limitations exist, including: (i) a low success rate, (ii) high algorithmic complexity, and (iii) a large number of test patterns. Furthermore, the most pertinent drawback of prior detection techniques stems from an incorrect evaluation methodology, i.e., they assume that an adversary inserts HTs randomly. Such inappropriate adversarial assumptions enable detection techniques to claim high HT detection accuracy, leading to a "false sense of security." Unfortunately, to the best of our knowledge, despite more than a decade of research on detecting HTs inserted during fabrication, there have been no concerted efforts to perform a systematic evaluation of HT detection techniques. In this paper, we play the role of a realistic adversary and question the efficacy of HT detection techniques by developing an automated, scalable, and practical attack framework, ATTRITION, using reinforcement learning (RL). ATTRITION evades eight detection techniques across two HT detection categories, showcasing its agnostic behavior. ATTRITION achieves average attack success rates of $47\times$ and $211\times$ compared to randomly inserted HTs against state-of-the-art HT detection techniques. We demonstrate ATTRITION's ability to evade detection techniques by evaluating designs ranging from the widely-used academic suites to larger designs such as the open-source MIPS and mor1kx processors to AES and a GPS module. Additionally, we showcase the impact of ATTRITION-generated HTs through two case studies (privilege escalation and kill switch) on the mor1kx processor. We envision that our work, along with our released HT benchmarks and models, fosters the development of better HT detection techniques.

Although Deep Neural Networks (DNN) have become the backbone technology of several ubiquitous applications, their deployment in resource-constrained machines, e.g., Internet of Things (IoT) devices, is still challenging. To satisfy the resource requirements of such a paradigm, collaborative deep inference with IoT synergy was introduced. However, the distribution of DNN networks suffers from severe data leakage. Various threats have been presented, including black-box attacks, where malicious participants can recover arbitrary inputs fed into their devices. Although many countermeasures were designed to achieve privacy-preserving DNN, most of them result in additional computation and lower accuracy. In this paper, we present an approach that targets the security of collaborative deep inference via re-thinking the distribution strategy, without sacrificing the model performance. Particularly, we examine different DNN partitions that make the model susceptible to black-box threats and we derive the amount of data that should be allocated per device to hide proprieties of the original input. We formulate this methodology, as an optimization, where we establish a trade-off between the latency of co-inference and the privacy-level of data. Next, to relax the optimal solution, we shape our approach as a Reinforcement Learning (RL) design that supports heterogeneous devices as well as multiple DNNs/datasets.

We introduce two block coordinate descent algorithms for solving optimization problems with ordinary differential equations (ODEs) as dynamical constraints. The algorithms do not need to implement direct or adjoint sensitivity analysis methods to evaluate loss function gradients. They results from reformulation of the original problem as an equivalent optimization problem with equality constraints. The algorithms naturally follow from steps aimed at recovering the gradient-decent algorithm based on ODE solvers that explicitly account for sensitivity of the ODE solution. In our first proposed algorithm we avoid explicitly solving the ODE by integrating the ODE solver as a sequence of implicit constraints. In our second algorithm, we use an ODE solver to reset the ODE solution, but no direct are adjoint sensitivity analysis methods are used. Both algorithm accepts mini-batch implementations and show significant efficiency benefits from GPU-based parallelization. We demonstrate the performance of the algorithms when applied to learning the parameters of the Cucker-Smale model. The algorithms are compared with gradient descent algorithms based on ODE solvers endowed with sensitivity analysis capabilities, for various number of state size, using Pytorch and Jax implementations. The experimental results demonstrate that the proposed algorithms are at least 4x faster than the Pytorch implementations, and at least 16x faster than Jax implementations. For large versions of the Cucker-Smale model, the Jax implementation is thousands of times faster than the sensitivity analysis-based implementation. In addition, our algorithms generate more accurate results both on training and test data. Such gains in computational efficiency is paramount for algorithms that implement real time parameter estimations, such as diagnosis algorithms.

Disease identification is a core, routine activity in observational health research. Cohorts impact downstream analyses, such as how a condition is characterized, how patient risk is defined, and what treatments are studied. It is thus critical to ensure that selected cohorts are representative of all patients, independently of their demographics or social determinants of health. While there are multiple potential sources of bias when constructing phenotype definitions which may affect their fairness, it is not standard in the field of phenotyping to consider the impact of different definitions across subgroups of patients. In this paper, we propose a set of best practices to assess the fairness of phenotype definitions. We leverage established fairness metrics commonly used in predictive models and relate them to commonly used epidemiological cohort description metrics. We describe an empirical study for Crohn's disease and diabetes type 2, each with multiple phenotype definitions taken from the literature across two sets of patient subgroups (gender and race). We show that the different phenotype definitions exhibit widely varying and disparate performance according to the different fairness metrics and subgroups. We hope that the proposed best practices can help in constructing fair and inclusive phenotype definitions.

As an emerging technology in the era of Industry 4.0, digital twin is gaining unprecedented attention because of its promise to further optimize process design, quality control, health monitoring, decision and policy making, and more, by comprehensively modeling the physical world as a group of interconnected digital models. In a two-part series of papers, we examine the fundamental role of different modeling techniques, twinning enabling technologies, and uncertainty quantification and optimization methods commonly used in digital twins. This second paper presents a literature review of key enabling technologies of digital twins, with an emphasis on uncertainty quantification, optimization methods, open source datasets and tools, major findings, challenges, and future directions. Discussions focus on current methods of uncertainty quantification and optimization and how they are applied in different dimensions of a digital twin. Additionally, this paper presents a case study where a battery digital twin is constructed and tested to illustrate some of the modeling and twinning methods reviewed in this two-part review. Code and preprocessed data for generating all the results and figures presented in the case study are available on GitHub.

Simulations of high energy density physics are expensive, largely in part for the need to produce non-local thermodynamic equilibrium opacities. High-fidelity spectra may reveal new physics in the simulations not seen with low-fidelity spectra, but the cost of these simulations also scale with the level of fidelity of the opacities being used. Neural networks are capable of reproducing these spectra, but neural networks need data to to train them which limits the level of fidelity of the training data. This paper demonstrates that it is possible to reproduce high-fidelity spectra with median errors in the realm of 3\% to 4\% using as few as 50 samples of high-fidelity Krypton data by performing transfer learning on a neural network trained on many times more low-fidelity data.

Consistently checking the statistical significance of experimental results is the first mandatory step towards reproducible science. This paper presents a hitchhiker's guide to rigorous comparisons of reinforcement learning algorithms. After introducing the concepts of statistical testing, we review the relevant statistical tests and compare them empirically in terms of false positive rate and statistical power as a function of the sample size (number of seeds) and effect size. We further investigate the robustness of these tests to violations of the most common hypotheses (normal distributions, same distributions, equal variances). Beside simulations, we compare empirical distributions obtained by running Soft-Actor Critic and Twin-Delayed Deep Deterministic Policy Gradient on Half-Cheetah. We conclude by providing guidelines and code to perform rigorous comparisons of RL algorithm performances.

In real-world applications of influence maximization (IM), the network structure is often unknown. Thus, we may identify the most influential seed nodes by exploring only a part of the underlying network given a small budget for node queries. Motivated by the fact that collecting node metadata is more cost-effective than investigating the relationship between nodes via queried nodes, we propose IM-META, an end-to-end solution to IM in networks with unknown topology by retrieving information from queries and node metadata. However, using such metadata to aid the IM process is not without risk due to the noisy nature of metadata and uncertainties in connectivity inference. To tackle these challenges, we formulate a new IM problem that aims to find both seed nodes and queried nodes. In IM-META, we develop an effective method that iteratively performs three steps: 1) we learn the relationship between collected metadata and edges via a Siamese neural network model, 2) we select a number of inferred confident edges to construct a reinforced graph, and 3) we identify the next node to query by maximizing the inferred influence spread using our topology-aware ranking strategy. By querying only 5% of nodes, IM-META reaches 93% of the upper bound performance.

Recent advances in Artificial Intelligence (AI) on the Internet of Things (IoT)-enabled network edge has realized edge intelligence in several applications such as smart agriculture, smart hospitals, and smart factories by enabling low-latency and computational efficiency. However, deploying state-of-the-art Convolutional Neural Networks (CNNs) such as VGG-16 and ResNets on resource-constrained edge devices is practically infeasible due to their large number of parameters and floating-point operations (FLOPs). Thus, the concept of network pruning as a type of model compression is gaining attention for accelerating CNNs on low-power devices. State-of-the-art pruning approaches, either structured or unstructured do not consider the different underlying nature of complexities being exhibited by convolutional layers and follow a training-pruning-retraining pipeline, which results in additional computational overhead. In this work, we propose a novel and computationally efficient pruning pipeline by exploiting the inherent layer-level complexities of CNNs. Unlike typical methods, our proposed complexity-driven algorithm selects a particular layer for filter-pruning based on its contribution to overall network complexity. We follow a procedure that directly trains the pruned model and avoids the computationally complex ranking and fine-tuning steps. Moreover, we define three modes of pruning, namely parameter-aware (PA), FLOPs-aware (FA), and memory-aware (MA), to introduce versatile compression of CNNs. Our results show the competitive performance of our approach in terms of accuracy and acceleration. Lastly, we present a trade-off between different resources and accuracy which can be helpful for developers in making the right decisions in resource-constrained IoT environments.

We propose a recommendation system that suggests treatment strategies to a therapist during the psychotherapy session in real-time. Our system uses a turn-level rating mechanism that predicts the therapeutic outcome by computing a similarity score between the deep embedding of a scoring inventory, and the current sentence that the patient is speaking. The system automatically transcribes a continuous audio stream and separates it into turns of the patient and of the therapist using an online registration-free diarization method. The dialogue pairs along with their computed ratings are then fed into a deep reinforcement learning recommender where the sessions are treated as users and the topics are treated as items. Other than evaluating the empirical advantages of the core components on existing datasets, we demonstrate the effectiveness of this system in a web app.

In many real world medical image classification settings we do not have access to samples of all possible disease classes, while a robust system is expected to give high performance in recognizing novel test data. We propose a generalized zero shot learning (GZSL) method that uses self supervised learning (SSL) for: 1) selecting anchor vectors of different disease classes; and 2) training a feature generator. Our approach does not require class attribute vectors which are available for natural images but not for medical images. SSL ensures that the anchor vectors are representative of each class. SSL is also used to generate synthetic features of unseen classes. Using a simpler architecture, our method matches a state of the art SSL based GZSL method for natural images and outperforms all methods for medical images. Our method is adaptable enough to accommodate class attribute vectors when they are available for natural images.

The internet of medical things (IoMT) allows the collection of physiological data using sensors, then their transmission to remote servers, which allows physicians and health professionals to analyze these data continuously and permanently and detect disease at an early stage. However, the use of wireless communication to transfer data exposes it to cyberattacks, and the sensitive and private nature of this data may represent a prime interest for attackers. Using traditional security methods on devices with limited storage and computing capacity is ineffective. On the other hand, using machine learning for intrusion detection can provide an adapted security response to the requirements of IoMT systems. In this context, a comprehensive survey on how machine learning (ML)-based intrusion detection systems address security and privacy issues in IoMT systems is performed. For this purpose, the generic three-layer architecture of IoMT and the security requirement of IoMT systems are provided. Then the various threats that can affect IoMT security are presented, and the advantages, disadvantages, methods, and datasets used in each solution based on ML are identified. Finally, some challenges and limitations of applying ML on each layer of IoMT are discussed, which can serve as a future research direction.

CountSketch and Feature Hashing (the "hashing trick") are popular randomized dimensionality reduction methods that support recovery of $\ell_2$-heavy hitters (keys $i$ where $v_i^2 > \epsilon \|\boldsymbol{v}\|_2^2$) and approximate inner products. When the inputs are {\em not adaptive} (do not depend on prior outputs), classic estimators applied to a sketch of size $O(\ell/\epsilon)$ are accurate for a number of queries that is exponential in $\ell$. When inputs are adaptive, however, an adversarial input can be constructed after $O(\ell)$ queries with the classic estimator and the best known robust estimator only supports $\tilde{O}(\ell^2)$ queries. In this work we show that this quadratic dependence is in a sense inherent: We design an attack that after $O(\ell^2)$ queries produces an adversarial input vector whose sketch is highly biased. Our attack uses "natural" non-adaptive inputs (only the final adversarial input is chosen adaptively) and universally applies with any correct estimator, including one that is unknown to the attacker. In that, we expose inherent vulnerability of this fundamental method.

Lateral Movement refers to methods by which threat actors gain initial access to a network and then progressively move through said network collecting key data about assets until they reach the ultimate target of their attack. Lateral Movement intrusions have become more intricate with the increasing complexity and interconnected nature of enterprise networks, and require equally sophisticated detection mechanisms to proactively detect such threats in near real-time at enterprise scale. In this paper, the authors propose a novel, lightweight method for Lateral Movement detection using user behavioral analysis and machine learning. Specifically, this paper introduces a novel methodology for cyber domain-specific feature engineering that identifies Lateral Movement behavior on a per-user basis. Furthermore, the engineered features have also been used to develop two supervised machine learning models for Lateral Movement identification that have demonstrably outperformed models previously seen in literature while maintaining robust performance on datasets with high class imbalance. The models and methodology introduced in this paper have also been designed in collaboration with security operators to be relevant and interpretable in order to maximize impact and minimize time to value as a cyber threat detection toolkit. The underlying goal of the paper is to provide a computationally efficient, domain-specific approach to near real-time Lateral Movement detection that is interpretable and robust to enterprise-scale data volumes and class imbalance.

We study stochastic decentralized optimization for the problem of training machine learning models with large-scale distributed data. We extend the widely used EXTRA and DIGing methods with variance reduction (VR), and propose two methods: VR-EXTRA and VR-DIGing. The proposed VR-EXTRA requires the time of $O((\kappa_s+n)\log\frac{1}{\epsilon})$ stochastic gradient evaluations and $O((\kappa_b+\kappa_c)\log\frac{1}{\epsilon})$ communication rounds to reach precision $\epsilon$, which are the best complexities among the non-accelerated gradient-type methods, where $\kappa_s$ and $\kappa_b$ are the stochastic condition number and batch condition number for strongly convex and smooth problems, respectively, $\kappa_c$ is the condition number of the communication network, and $n$ is the sample size on each distributed node. The proposed VR-DIGing has a little higher communication cost of $O((\kappa_b+\kappa_c^2)\log\frac{1}{\epsilon})$. Our stochastic gradient computation complexities are the same as the ones of single-machine VR methods, such as SAG, SAGA, and SVRG, and our communication complexities keep the same as those of EXTRA and DIGing, respectively. To further speed up the convergence, we also propose the accelerated VR-EXTRA and VR-DIGing with both the optimal $O((\sqrt{n\kappa_s}+n)\log\frac{1}{\epsilon})$ stochastic gradient computation complexity and $O(\sqrt{\kappa_b\kappa_c}\log\frac{1}{\epsilon})$ communication complexity. Our stochastic gradient computation complexity is also the same as the ones of single-machine accelerated VR methods, such as Katyusha, and our communication complexity keeps the same as those of accelerated full batch decentralized methods, such as MSDA.

We show that every $d$-dimensional probability distribution of bounded support can be generated through deep ReLU networks out of a $1$-dimensional uniform input distribution. What is more, this is possible without incurring a cost - in terms of approximation error measured in Wasserstein-distance - relative to generating the $d$-dimensional target distribution from $d$ independent random variables. This is enabled by a vast generalization of the space-filling approach discovered in (Bailey & Telgarsky, 2018). The construction we propose elicits the importance of network depth in driving the Wasserstein distance between the target distribution and its neural network approximation to zero. Finally, we find that, for histogram target distributions, the number of bits needed to encode the corresponding generative network equals the fundamental limit for encoding probability distributions as dictated by quantization theory.

Understanding human behavior and monitoring mental health are essential to maintaining the community and society's safety. As there has been an increase in mental health problems during the COVID-19 pandemic due to uncontrolled mental health, early detection of mental issues is crucial. Nowadays, the usage of Intelligent Virtual Personal Assistants (IVA) has increased worldwide. Individuals use their voices to control these devices to fulfill requests and acquire different services. This paper proposes a novel deep learning model based on the gated recurrent neural network and convolution neural network to understand human emotion from speech to improve their IVA services and monitor their mental health.

In this paper, a new methodology is proposed that allows for the low-complexity development of neural network (NN) based equalizers for the mitigation of impairments in high-speed coherent optical transmission systems. In this work, we provide a comprehensive description and comparison of various deep model compression approaches that have been applied to feed-forward and recurrent NN designs. Additionally, we evaluate the influence these strategies have on the performance of each NN equalizer. Quantization, weight clustering, pruning, and other cutting-edge strategies for model compression are taken into consideration. In this work, we propose and evaluate a Bayesian optimization-assisted compression, in which the hyperparameters of the compression are chosen to simultaneously reduce complexity and improve performance. In conclusion, the trade-off between the complexity of each compression approach and its performance is evaluated by utilizing both simulated and experimental data in order to complete the analysis. By utilizing optimal compression approaches, we show that it is possible to design an NN-based equalizer that is simpler to implement and has better performance than the conventional digital back-propagation (DBP) equalizer with only one step per span. This is accomplished by reducing the number of multipliers used in the NN equalizer after applying the weighted clustering and pruning algorithms. Furthermore, we demonstrate that an equalizer based on NN can also achieve superior performance while still maintaining the same degree of complexity as the full electronic chromatic dispersion compensation block. We conclude our analysis by highlighting open questions and existing challenges, as well as possible future research directions.

Recent studies have proven that graph neural networks are vulnerable to adversarial attacks. Attackers can rely solely on the training labels to disrupt the performance of the agnostic victim model by edge perturbations. Researchers observe that the saliency-based attackers tend to add edges rather than delete them, which is previously explained by the fact that adding edges pollutes the nodes' features by aggregation while removing edges only leads to some loss of information. In this paper, we further prove that the attackers perturb graphs by adding inter-class edges, which also manifests as a reduction in the homophily of the perturbed graph. From this point of view, saliency-based attackers still have room for improvement in capability and imperceptibility. The message passing of the GNN-based surrogate model leads to the oversmoothing of nodes connected by inter-class edges, preventing attackers from obtaining the distinctiveness of node features. To solve this issue, we introduce a multi-hop aggregated message passing to preserve attribute differences between nodes. In addition, we propose a regularization term to restrict the homophily variance to enhance the attack imperceptibility. Experiments verify that our proposed surrogate model improves the attacker's versatility and the regularization term helps to limit the homophily of the perturbed graph.

Measuring a document's complexity level is an open challenge, particularly when one is working on a diverse corpus of documents rather than comparing several documents on a similar topic or working on a language other than English. In this paper, we define a methodology to measure the complexity of French documents, using a new general and diversified corpus of texts, the "French Canadian complexity level corpus", and a wide range of metrics. We compare different learning algorithms to this task and contrast their performances and their observations on which characteristics of the texts are more significant to their complexity. Our results show that our methodology gives a general-purpose measurement of text complexity in French.

This work is focused on the pruning of some convolutional neural networks (CNNs) and improving theirs efficiency on graphic processing units (GPU) by using a direct sparse algorithm. The Nvidia deep neural network (cuDnn) library is the most effective implementations of deep learning (DL) algorithms for GPUs. GPUs are the most commonly used accelerators for deep learning computations. One of the most common techniques for improving the efficiency of CNN models is weight pruning and quantization. There are two main types of pruning: structural and non-structural. The first enables much easier acceleration on many type of accelerators, but with this type it is difficult to achieve a sparsity level and accuracy as high as that obtained with the second type. Non-structural pruning with retraining can generate a weight tensors up to 90% or more of sparsity in some deep CNN models. In this article the pruning algorithm is presented which makes it possible to achieve high sparsity levels without accuracy drop. In the next stage the linear and non-linear quantization is adapted for further time and footprint reduction. This paper is an extended of previously published paper concerning effective pruning techniques and present real models pruned with high sparsities and reduced precision which can achieve better performance than the CuDnn library.

Gaussian processes are a key component of many flexible statistical and machine learning models. However, they exhibit cubic computational complexity and high memory constraints due to the need of inverting and storing a full covariance matrix. To circumvent this, mixtures of Gaussian process experts have been considered where data points are assigned to independent experts, reducing the complexity by allowing inference based on smaller, local covariance matrices. Moreover, mixtures of Gaussian process experts substantially enrich the model's flexibility, allowing for behaviors such as non-stationarity, heteroscedasticity, and discontinuities. In this work, we construct a novel inference approach based on nested sequential Monte Carlo samplers to simultaneously infer both the gating network and Gaussian process expert parameters. This greatly improves inference compared to importance sampling, particularly in settings when a stationary Gaussian process is inappropriate, while still being thoroughly parallelizable.

Federated learning is a model for privacy without revealing private data by transfer models instead of personal and private data from local client devices. While, in the global model, it's crucial to recognize each local data is normal. This paper suggests one method to separate normal locals and abnormal locals by Euclidean similarity clustering of vectors extracted by inputting dummy data in local models. In a federated classification model, this method divided locals into normal and abnormal.

Insertion of hardware Trojans (HTs) in integrated circuits is a pernicious threat. Since HTs are activated under rare trigger conditions, detecting them using random logic simulations is infeasible. In this work, we design a reinforcement learning (RL) agent that circumvents the exponential search space and returns a minimal set of patterns that is most likely to detect HTs. Experimental results on a variety of benchmarks demonstrate the efficacy and scalability of our RL agent, which obtains a significant reduction ($169\times$) in the number of test patterns required while maintaining or improving coverage ($95.75\%$) compared to the state-of-the-art techniques.

Multiresolution deep learning approaches, such as the U-Net architecture, have achieved high performance in classifying and segmenting images. However, these approaches do not provide a latent image representation and cannot be used to decompose, denoise, and reconstruct image data. The U-Net and other convolutional neural network (CNNs) architectures commonly use pooling to enlarge the receptive field, which usually results in irreversible information loss. This study proposes to include a Riesz-Quincunx (RQ) wavelet transform, which combines 1) higher-order Riesz wavelet transform and 2) orthogonal Quincunx wavelets (which have both been used to reduce blur in medical images) inside the U-net architecture, to reduce noise in satellite images and their time-series. In the transformed feature space, we propose a variational approach to understand how random perturbations of the features affect the image to further reduce noise. Combining both approaches, we introduce a hybrid RQUNet-VAE scheme for image and time series decomposition used to reduce noise in satellite imagery. We present qualitative and quantitative experimental results that demonstrate that our proposed RQUNet-VAE was more effective at reducing noise in satellite imagery compared to other state-of-the-art methods. We also apply our scheme to several applications for multi-band satellite images, including: image denoising, image and time-series decomposition by diffusion and image segmentation.

A seminal work [Jacot et al., 2018] demonstrated that training a neural network under specific parameterization is equivalent to performing a particular kernel method as width goes to infinity. This equivalence opened a promising direction for applying the results of the rich literature on kernel methods to neural nets which were much harder to tackle. The present survey covers key results on kernel convergence as width goes to infinity, finite-width corrections, applications, and a discussion of the limitations of the corresponding method.

The disruption of circadian rhythm is a cardinal symptom for Alzheimer's disease (AD) patients. The full circadian rhythm orchestration of gene expression in the human brain and its inherent associations with AD remain largely unknown. We present a novel comprehensive approach, PRIME, to detect and analyze rhythmic oscillation patterns in untimed high-dimensional gene expression data across multiple datasets. To demonstrate the utility of PRIME, firstly, we validate it by a time course expression dataset from mouse liver as a cross-species and cross-organ validation. Then, we apply it to study oscillation patterns in untimed genome-wide gene expression from 19 human brain regions of controls and AD patients. Our findings reveal clear, synchronized oscillation patterns in 15 pairs of brain regions of control, while these oscillation patterns either disappear or dim for AD. It is worth noting that PRIME discovers the circadian rhythmic patterns without requiring the sample's timestamps. The codes for PRIME, along with codes to reproduce the figures in this paper, are available at https://github.com/xinxingwu-uk/PRIME.

Among the main features of biological intelligence are energy efficiency, capacity for continual adaptation, and risk management via uncertainty quantification. Neuromorphic engineering has been thus far mostly driven by the goal of implementing energy-efficient machines that take inspiration from the time-based computing paradigm of biological brains. In this paper, we take steps towards the design of neuromorphic systems that are capable of adaptation to changing learning tasks, while producing well-calibrated uncertainty quantification estimates. To this end, we derive online learning rules for spiking neural networks (SNNs) within a Bayesian continual learning framework. In it, each synaptic weight is represented by parameters that quantify the current epistemic uncertainty resulting from prior knowledge and observed data. The proposed online rules update the distribution parameters in a streaming fashion as data are observed. We instantiate the proposed approach for both real-valued and binary synaptic weights. Experimental results using Intel's Lava platform show the merits of Bayesian over frequentist learning in terms of capacity for adaptation and uncertainty quantification.

The Gumbel-Softmax is a continuous distribution over the simplex that is often used as a relaxation of discrete distributions. Because it can be readily interpreted and easily reparameterized, it enjoys widespread use. We propose a modular and more flexible family of reparameterizable distributions where Gaussian noise is transformed into a one-hot approximation through an invertible function. This invertible function is composed of a modified softmax and can incorporate diverse transformations that serve different specific purposes. For example, the stick-breaking procedure allows us to extend the reparameterization trick to distributions with countably infinite support, thus enabling the use of our distribution along nonparametric models, or normalizing flows let us increase the flexibility of the distribution. Our construction enjoys theoretical advantages over the Gumbel-Softmax, such as closed form KL, and significantly outperforms it in a variety of experiments. Our code is available at https://github.com/cunningham-lab/igr.

This manuscript addresses the simultaneous problems of predicting all-cause inpatient readmission or death after discharge, and quantifying the impact of discharge placement in preventing these adverse events. To this end, we developed an inherently interpretable multilevel Bayesian modeling framework inspired by the piecewise linearity of ReLU-activated deep neural networks. In a survival model, we explicitly adjust for confounding in quantifying local average treatment effects for discharge placement interventions. We trained the model on a 5% sample of Medicare beneficiaries from 2008 and 2011, and then tested the model on 2012 claims. Evaluated on classification accuracy for 30-day all-cause unplanned readmissions (defined using official CMS methodology) or death, the model performed similarly against XGBoost, logistic regression (after feature engineering), and a Bayesian deep neural network trained on the same data. Tested on the 30-day classification task of predicting readmissions or death using left-out future data, the model achieved an AUROC of approximately 0.76 and and AUPRC of approximately 0.50 (relative to an overall positively rate in the testing data of 18%), demonstrating how one need not sacrifice interpretability for accuracy. Additionally, the model had a testing AUROC of 0.78 on the classification of 90-day all-cause unplanned readmission or death. We easily peer into our inherently interpretable model, summarizing its main findings. Additionally, we demonstrate how the black-box posthoc explainer tool SHAP generates explanations that are not supported by the fitted model -- and if taken at face value does not offer enough context to make a model actionable.

Many applications of reinforcement learning can be formalized as goal-conditioned environments, where, in each episode, there is a "goal" that affects the rewards obtained during that episode but does not affect the dynamics. Various techniques have been proposed to improve performance in goal-conditioned environments, such as automatic curriculum generation and goal relabeling. In this work, we explore a connection between off-policy reinforcement learning in goal-conditioned settings and knowledge distillation. In particular: the current Q-value function and the target Q-value estimate are both functions of the goal, and we would like to train the Q-value function to match its target for all goals. We therefore apply Gradient-Based Attention Transfer (Zagoruyko and Komodakis 2017), a knowledge distillation technique, to the Q-function update. We empirically show that this can improve the performance of goal-conditioned off-policy reinforcement learning when the space of goals is high-dimensional. We also show that this technique can be adapted to allow for efficient learning in the case of multiple simultaneous sparse goals, where the agent can attain a reward by achieving any one of a large set of objectives, all specified at test time. Finally, to provide theoretical support, we give examples of classes of environments where (under some assumptions) standard off-policy algorithms require at least O(d^2) observed transitions to learn an optimal policy, while our proposed technique requires only O(d) transitions, where d is the dimensionality of the goal and state space.

This paper describes a new approach for learning structures of large Bayesian networks based on blocks resulting from feature space clustering. This clustering is obtained using normalized mutual information. And the subsequent aggregation of blocks is done using classical learning methods except that they are input with compressed information about combinations of feature values for each block. Validation of this approach is done for Hill-Climbing as a graph enumeration algorithm for two score functions: BIC and MI. In this way, potentially parallelizable block learning can be implemented even for those score functions that are considered unsuitable for parallelizable learning. The advantage of the approach is evaluated in terms of speed of work as well as the accuracy of the found structures.

Learning a predictive model of the mean return, or value function, plays a critical role in many reinforcement learning algorithms. Distributional reinforcement learning (DRL) methods instead model the value distribution, which has been shown to improve performance in many settings. In this paper, we model the value distribution as approximately normal using the Markov Chain central limit theorem. We analytically compute quantile bars to provide a new DRL target that is informed by the decrease in standard deviation that occurs over the course of an episode. In addition, we suggest an exploration strategy based on how closely the learned value distribution resembles the target normal distribution to make the value function more accurate for better policy improvement. The approach we outline is compatible with many DRL structures. We use proximal policy optimization as a testbed and show that both the normality-guided target and exploration bonus produce performance improvements. We demonstrate our method outperforms DRL baselines on a number of continuous control tasks.

With the advent of the big data era, the data quality problem is becoming more and more crucial. Among many factors, data with missing values is one primary issue, and thus developing effective imputation models is a key topic in the research community. Recently, a major research direction is to employ neural network models such as selforganizing mappings or automatic encoders for filling missing values. However, these classical methods can hardly discover correlation features and common features simultaneously among data attributes. Especially,it is a very typical problem for classical autoencoders that they often learn invalid constant mappings, thus dramatically hurting the filling performance. To solve the above problems, we propose and develop a missing-value-filling model based on a feature-fusion-enhanced autoencoder. We first design and incorporate into an autoencoder a hidden layer that consists of de-tracking neurons and radial basis function neurons, which can enhance the ability to learn correlated features and common features. Besides, we develop a missing value filling strategy based on dynamic clustering (MVDC) that is incorporated into an iterative optimization process. This design can enhance the multi-dimensional feature fusion ability and thus improves the dynamic collaborative missing-value-filling performance. The effectiveness of our model is validated by experimental comparisons to many missing-value-filling methods that are tested on seven datasets with different missing rates.

We consider communication in a fully cooperative multi-agent system, where the agents have partial observation of the environment and must act jointly to maximize the overall reward. We have a discrete-time queueing network where agents route packets to queues based only on the partial information of the current queue lengths. The queues have limited buffer capacity, so packet drops happen when they are sent to a full queue. In this work, we implemented a communication channel for the agents to share their information in order to reduce the packet drop rate. For efficient information sharing we use an attention-based communication model, called ATVC, to select informative messages from other agents. The agents then infer the state of queues using a combination of the variational auto-encoder, VAE, and product-of-experts, PoE, model. Ultimately, the agents learn what they need to communicate and with whom, instead of communicating all the time with everyone. We also show empirically that ATVC is able to infer the true state of the queues and leads to a policy which outperforms existing baselines.

Limited computation and communication capabilities of clients pose significant challenges in federated learning (FL) over resource-limited edge nodes. A potential solution to this problem is to deploy off-the-shelf sparse learning algorithms that train a binary sparse mask on each client with the expectation of training a consistent sparse server mask. However, as we investigate in this paper, such naive deployments result in a significant accuracy drop compared to FL with dense models, especially under low client's resource budget. In particular, our investigations reveal a serious lack of consensus among the trained masks on clients, which prevents convergence on the server mask and potentially leads to a substantial drop in model performance. Based on such key observations, we propose federated lottery aware sparsity hunting (FLASH), a unified sparse learning framework to make the server win a lottery in terms of a sparse sub-model, which can greatly improve performance under highly resource-limited client settings. Moreover, to address the issue of device heterogeneity, we leverage our findings to propose hetero-FLASH, where clients can have different target sparsity budgets based on their device resource limits. Extensive experimental evaluations with multiple models on various datasets (both IID and non-IID) show superiority of our models in yielding up to $\mathord{\sim}10.1\%$ improved accuracy with $\mathord{\sim}10.26\times$ fewer communication costs, compared to existing alternatives, at similar hyperparameter settings.

Clustering attempts to partition data instances into several distinctive groups, while the similarities among data belonging to the common partition can be principally reserved. Furthermore, incomplete data frequently occurs in many realworld applications, and brings perverse influence on pattern analysis. As a consequence, the specific solutions to data imputation and handling are developed to conduct the missing values of data, and independent stage of knowledge exploitation is absorbed for information understanding. In this work, a novel approach to clustering of incomplete data, termed leachable component clustering, is proposed. Rather than existing methods, the proposed method handles data imputation with Bayes alignment, and collects the lost patterns in theory. Due to the simple numeric computation of equations, the proposed method can learn optimized partitions while the calculation efficiency is held. Experiments on several artificial incomplete data sets demonstrate that, the proposed method is able to present superior performance compared with other state-of-the-art algorithms.

With COVID-19 now pervasive, identification of high-risk individuals is crucial. Using data from a major healthcare provider in Southwestern Pennsylvania, we develop survival models predicting severe COVID-19 progression. In this endeavor, we face a tradeoff between more accurate models relying on many features and less accurate models relying on a few features aligned with clinician intuition. Complicating matters, many EHR features tend to be under-coded, degrading the accuracy of smaller models. In this study, we develop two sets of high-performance risk scores: (i) an unconstrained model built from all available features; and (ii) a pipeline that learns a small set of clinical concepts before training a risk predictor. Learned concepts boost performance over the corresponding features (C-index 0.858 vs. 0.844) and demonstrate improvements over (i) when evaluated out-of-sample (subsequent time periods). Our models outperform previous works (C-index 0.844-0.872 vs. 0.598-0.810).

We present a new efficient OpenCL-based Accelerator for large scale Convolutional Neural Networks called Fast Inference on FPGAs for Convolution Neural Network (FFCNN). FFCNN is based on a deeply pipelined OpenCL kernels architecture. As pointed out before, high-level synthesis tools such as the OpenCL framework can easily port codes originally designed for CPUs and GPUs to FPGAs, but it is still difficult to make OpenCL codes run efficiently on FPGAs. This work aims to propose an efficient FPGA implementation of OpenCL High-Performance Computing Applications. To do so, a Data reuse and task mapping techniques are also presented to improve design efficiency. In addition, the following motivations were taken into account when developing FFCNN: 1) FFCNN has been designed to be easily implemented on Intel OpenCL SDK based FPGA design flow. 2) In FFFCN, different techniques have been integrated to improve the memory band with and throughput. A performance analysis is conducted on two deep CNN for Large-Scale Images classification. The obtained results, and the comparison with other works designed to accelerate the same types of architectures, show the efficiency and the competitiveness of the proposed accelerator design by significantly improved performance and resource utilization.

Modern approaches for simulation-based inference rely upon deep learning surrogates to enable approximate inference with computer simulators. In practice, the estimated posteriors' computational faithfulness is, however, rarely guaranteed. For example, Hermans et al. (2021) show that current simulation-based inference algorithms can produce posteriors that are overconfident, hence risking false inferences. In this work, we introduce Balanced Neural Ratio Estimation (BNRE), a variation of the NRE algorithm designed to produce posterior approximations that tend to be more conservative, hence improving their reliability, while sharing the same Bayes optimal solution. We achieve this by enforcing a balancing condition that increases the quantified uncertainty in small simulation budget regimes while still converging to the exact posterior as the budget increases. We provide theoretical arguments showing that BNRE tends to produce posterior surrogates that are more conservative than NRE's. We evaluate BNRE on a wide variety of tasks and show that it produces conservative posterior surrogates on all tested benchmarks and simulation budgets. Finally, we emphasize that BNRE is straightforward to implement over NRE and does not introduce any computational overhead.

Accelerated MRI reconstructs images of clinical anatomies from sparsely sampled signal data to reduce patient scan times. While recent works have leveraged deep learning to accomplish this task, such approaches have often only been explored in simulated environments where there is no signal corruption or resource limitations. In this work, we explore augmentations to neural network MRI image reconstructors to enhance their clinical relevancy. Namely, we propose a ConvNet model for detecting sources of image artifacts that achieves a classifer $F_2$ score of $79.1\%$. We also demonstrate that training reconstructors on MR signal data with variable acceleration factors can improve their average performance during a clinical patient scan by up to $2\%$. We offer a loss function to overcome catastrophic forgetting when models learn to reconstruct MR images of multiple anatomies and orientations. Finally, we propose a method for using simulated phantom data to pre-train reconstructors in situations with limited clinically acquired datasets and compute capabilities. Our results provide a potential path forward for clinical adaptation of accelerated MRI.

Full waveform inversion (FWI) is widely used in geophysics to reconstruct high-resolution velocity maps from seismic data. The recent success of data-driven FWI methods results in a rapidly increasing demand for open datasets to serve the geophysics community. We present OpenFWI, a collection of large-scale multi-structural benchmark datasets, to facilitate diversified, rigorous, and reproducible research on FWI. In particular, OpenFWI consists of 12 datasets (2.1TB in total) synthesized from multiple sources. It encompasses diverse domains in geophysics (interface, fault, CO2 reservoir, etc.), covers different geological subsurface structures (flat, curve, etc.), and contains various amounts of data samples (2K - 67K). It also includes a dataset for 3D FWI. Moreover, we use OpenFWI to perform benchmarking over four deep learning methods, covering both supervised and unsupervised learning regimes. Along with the benchmarks, we implement additional experiments, including physics-driven methods, complexity analysis, generalization study, uncertainty quantification, and so on, to sharpen our understanding of datasets and methods. The studies either provide valuable insights into the datasets and the performance, or uncover their current limitations. We hope OpenFWI supports prospective research on FWI and inspires future open-source efforts on AI for science. All datasets and related information can be accessed through our website at https://openfwi-lanl.github.io/

Continual Learning (CL) investigates how to train Deep Networks on a stream of tasks without incurring forgetting. CL settings proposed in literature assume that every incoming example is paired with ground-truth annotations. However, this clashes with many real-world applications: gathering labeled data, which is in itself tedious and expensive, becomes infeasible when data flow as a stream. This work explores Continual Semi-Supervised Learning (CSSL): here, only a small fraction of labeled input examples are shown to the learner. We assess how current CL methods (e.g.: EWC, LwF, iCaRL, ER, GDumb, DER) perform in this novel and challenging scenario, where overfitting entangles forgetting. Subsequently, we design a novel CSSL method that exploits metric learning and consistency regularization to leverage unlabeled examples while learning. We show that our proposal exhibits higher resilience to diminishing supervision and, even more surprisingly, relying only on 25% supervision suffices to outperform SOTA methods trained under full supervision.

Deep learning models are known to be vulnerable to adversarial examples that are elaborately designed for malicious purposes and are imperceptible to the human perceptual system. Autoencoder, when trained solely over benign examples, has been widely used for (self-supervised) adversarial detection based on the assumption that adversarial examples yield larger reconstruction errors. However, because lacking adversarial examples in its training and the too strong generalization ability of autoencoder, this assumption does not always hold true in practice. To alleviate this problem, we explore how to detect adversarial examples with disentangled label/semantic features under the autoencoder structure. Specifically, we propose Disentangled Representation-based Reconstruction (DRR). In DRR, we train an autoencoder over both correctly paired label/semantic features and incorrectly paired label/semantic features to reconstruct benign and counterexamples. This mimics the behavior of adversarial examples and can reduce the unnecessary generalization ability of autoencoder. We compare our method with the state-of-the-art self-supervised detection methods under different adversarial attacks and different victim models, and it exhibits better performance in various metrics (area under the ROC curve, true positive rate, and true negative rate) for most attack settings. Though DRR is initially designed for visual tasks only, we demonstrate that it can be easily extended for natural language tasks as well. Notably, different from other autoencoder-based detectors, our method can provide resistance to the adaptive adversary.

Throughout the coronavirus disease 2019 (COVID-19) pandemic, decision makers have relied on forecasting models to determine and implement non-pharmaceutical interventions (NPI). In building the forecasting models, continuously updated datasets from various stakeholders including developers, analysts, and testers are required to provide precise predictions. Here we report the design of a scalable pipeline which serves as a data synchronization to support inter-country top-down spatiotemporal observations and forecasting models of COVID-19, named the where2test, for Germany, Czechia and Poland. We have built an operational data store (ODS) using PostgreSQL to continuously consolidate datasets from multiple data sources, perform collaborative work, facilitate high performance data analysis, and trace changes. The ODS has been built not only to store the COVID-19 data from Germany, Czechia, and Poland but also other areas. Employing the dimensional fact model, a schema of metadata is capable of synchronizing the various structures of data from those regions, and is scalable to the entire world. Next, the ODS is populated using batch Extract, Transfer, and Load (ETL) jobs. The SQL queries are subsequently created to reduce the need for pre-processing data for users. The data can then support not only forecasting using a version-controlled Arima-Holt model and other analyses to support decision making, but also risk calculator and optimisation apps. The data synchronization runs at a daily interval, which is displayed at https://www.where2test.de.

It is known that unsupervised nonlinear dimensionality reduction and clustering is sensitive to the selection of hyperparameters, particularly for deep learning based methods, which hinders its practical use. How to select a proper network structure that may be dramatically different in different applications is a hard issue for deep models, given little prior knowledge of data. In this paper, we aim to automatically determine the optimal network structure of a deep model, named multilayer bootstrap networks (MBN), via simple ensemble learning and selection techniques. Specifically, we first propose an MBN ensemble (MBN-E) algorithm which concatenates the sparse outputs of a set of MBN base models with different network structures into a new representation. Then, we take the new representation produced by MBN-E as a reference for selecting the optimal MBN base models. Moreover, we propose a fast version of MBN-E (fMBN-E), which is not only theoretically even faster than a single standard MBN but also does not increase the estimation error of MBN-E. Importantly, MBN-E and its ensemble selection techniques maintain the simple formulation of MBN that is based on one-nearest-neighbor learning. Empirically, comparing to a number of advanced deep clustering methods and as many as 20 representative unsupervised ensemble learning and selection methods, the proposed methods reach the state-of-the-art performance without manual hyperparameter tuning. fMBN-E is empirically even hundreds of times faster than MBN-E without suffering performance degradation. The applications to image segmentation and graph data mining further demonstrate the advantage of the proposed methods.

We propose a multimodal (vision-and-language) benchmark for cooperative and heterogeneous multi-agent learning. We introduce a benchmark multimodal dataset with tasks involving collaboration between multiple simulated heterogeneous robots in a rich multi-room home environment. We provide an integrated learning framework, multimodal implementations of state-of-the-art multi-agent reinforcement learning techniques, and a consistent evaluation protocol. Our experiments investigate the impact of different modalities on multi-agent learning performance. We also introduce a simple message passing method between agents. The results suggest that multimodality introduces unique challenges for cooperative multi-agent learning and there is significant room for advancing multi-agent reinforcement learning methods in such settings.

Breathing disorders such as sleep apnea is a critical disorder that affects a large number of individuals due to the insufficient capacity of the lungs to contain/exchange oxygen and carbon dioxide to ensure that the body is in the stable state of homeostasis. Respiratory Measurements such as minute ventilation can be used in correlation with other physiological measurements such as heart rate and heart rate variability for remote monitoring of health and detecting symptoms of such breathing related disorders. In this work, we formulate a deep learning based approach to measure remote ventilation on a private dataset. The dataset will be made public upon acceptance of this work. We use two versions of a deep neural network to estimate the minute ventilation from data streams obtained through wearable heart rate and respiratory devices. We demonstrate that the simple design of our pipeline - which includes lightweight deep neural networks - can be easily incorporate into real time health monitoring systems.

Recently, the EAGL-I system was developed to rapidly create massive labeled datasets of plants intended to be commonly used by farmers and researchers to create AI-driven solutions in agriculture. As a result, a publicly available plant species recognition dataset composed of 40,000 images with different sizes consisting of 8 plant species was created with the system in order to demonstrate its capabilities. This paper proposes a novel method, called Variably Overlapping Time-Coherent Sliding Window (VOTCSW), that transforms a dataset composed of images with variable size to a 3D representation with fixed size that is suitable for convolutional neural networks, and demonstrates that this representation is more informative than resizing the images of the dataset to a given size. We theoretically formalized the use cases of the method as well as its inherent properties and we proved that it has an oversampling and a regularization effect on the data. By combining the VOTCSW method with the 3D extension of a recently proposed machine learning model called 1-Dimensional Polynomial Neural Networks, we were able to create a model that achieved a state-of-the-art accuracy of 99.9% on the dataset created by the EAGL-I system, surpassing well-known architectures such as ResNet and Inception. In addition, we created a heuristic algorithm that enables the degree reduction of any pre-trained N-Dimensional Polynomial Neural Network and which compresses it without altering its performance, thus making the model faster and lighter. Furthermore, we established that the currently available dataset could not be used for machine learning in its present form, due to a substantial class imbalance between the training set and the test set. Hence, we created a specific preprocessing and a model development framework that enabled us to improve the accuracy from 49.23% to 99.9%.

Iterative solvers of linear systems are a key component for the numerical solutions of partial differential equations (PDEs). While there have been intensive studies through past decades on classical methods such as Jacobi, Gauss-Seidel, conjugate gradient, multigrid methods and their more advanced variants, there is still a pressing need to develop faster, more robust and reliable solvers. Based on recent advances in scientific deep learning for operator regression, we propose HINTS, a hybrid, iterative, numerical, and transferable solver for differential equations. HINTS combines standard relaxation methods and the Deep Operator Network (DeepONet). Compared to standard numerical solvers, HINTS is capable of providing faster solutions for a wide class of differential equations, while preserving the accuracy close to machine zero. Through an eigenmode analysis, we find that the individual solvers in HINTS target distinct regions in the spectrum of eigenmodes, resulting in a uniform convergence rate and hence exceptional performance of the hybrid solver overall. Moreover, HINTS applies to equations in multidimensions, and is flexible with regards to computational domain and transferable to different discretizations.  ( 3 min )

Federated learning (FL) is a new distributed machine learning framework that can achieve reliably collaborative training without collecting users' private data. However, due to FL's frequent communication and average aggregation strategy, they experience challenges scaling to statistical diversity data and large-scale models. In this paper, we propose a personalized FL framework, named Tensor Decomposition based Personalized Federated learning (TDPFed), in which we design a novel tensorized local model with tensorized linear layers and convolutional layers to reduce the communication cost. TDPFed uses a bi-level loss function to decouple personalized model optimization from the global model learning by controlling the gap between the personalized model and the tensorized local model. Moreover, an effective distributed learning strategy and two different model aggregation strategies are well designed for the proposed TDPFed framework. Theoretical convergence analysis and thorough experiments demonstrate that our proposed TDPFed framework achieves state-of-the-art performance while reducing the communication cost.  ( 2 min )

Spiking Neural Networks (SNNs) provide an efficient computational mechanism for temporal signal processing, especially when coupled with low-power SNN inference ASICs. SNNs have been historically difficult to configure, lacking a general method for finding solutions for arbitrary tasks. In recent years, gradient-descent optimization methods have been applied to SNNs with increasing ease. SNNs and SNN inference processors therefore offer a good platform for commercial low-power signal processing in energy constrained environments without cloud dependencies. However, to date these methods have not been accessible to ML engineers in industry, requiring graduate-level training to successfully configure a single SNN application. Here we demonstrate a convenient high-level pipeline to design, train and deploy arbitrary temporal signal processing applications to sub-mW SNN inference hardware. We apply a new straightforward SNN architecture designed for temporal signal processing, using a pyramid of synaptic time constants to extract signal features at a range of temporal scales. We demonstrate this architecture on an ambient audio classification task, deployed to the Xylo SNN inference processor in streaming mode. Our application achieves high accuracy (98%) and low latency (100ms) at low power (<4muW inference power). Our approach makes training and deploying SNN applications available to ML engineers with general NN backgrounds, without requiring specific prior experience with spiking NNs. We intend for our approach to make Neuromorphic hardware and SNNs an attractive choice for commercial low-power and edge signal processing applications.  ( 3 min )

Disruption prediction has made rapid progress in recent years, especially in machine learning (ML)-based methods. Understanding why a predictor makes a certain prediction can be as crucial as the prediction's accuracy for future tokamak disruption predictors. The purpose of most disruption predictors is accuracy or cross-machine capability. However, if a disruption prediction model can be interpreted, it can tell why certain samples are classified as disruption precursors. This allows us to tell the types of incoming disruption and gives us insight into the mechanism of disruption. This paper designs a disruption predictor called Interpretable Disruption Predictor based On Physics-guided feature extraction (IDP-PGFE) on J-TEXT. The prediction performance of the model is effectively improved by extracting physics-guided features. A high-performance model is required to ensure the validity of the interpretation results. The interpretability study of IDP-PGFE provides an understanding of J-TEXT disruption and is generally consistent with existing comprehension of disruption. IDP-PGFE has been applied to the disruption due to continuously increasing density towards density limit experiments on J-TEXT. The time evolution of the PGFE features contribution demonstrates that the application of ECRH triggers radiation-caused disruption, which lowers the density at disruption. While the application of RMP indeed raises the density limit in J-TEXT. The interpretability study guides intuition on the physical mechanisms of density limit disruption that RMPs affect not only the MHD instabilities but also the radiation profile, which delays density limit disruption.  ( 3 min )

As special information carriers containing both structure and feature information, graphs are widely used in graph mining, e.g., Graph Neural Networks (GNNs). However, in some practical scenarios, graph data are stored separately in multiple distributed parties, which may not be directly shared due to conflicts of interest. Hence, federated graph neural networks are proposed to address such data silo problems while preserving the privacy of each party (or client). Nevertheless, different graph data distributions among various parties, which is known as the statistical heterogeneity, may degrade the performance of naive federated learning algorithms like FedAvg. In this paper, we propose FedEgo, a federated graph learning framework based on ego-graphs to tackle the challenges above, where each client will train their local models while also contributing to the training of a global model. FedEgo applies GraphSAGE over ego-graphs to make full use of the structure information and utilizes Mixup for privacy concerns. To deal with the statistical heterogeneity, we integrate personalization into learning and propose an adaptive mixing coefficient strategy that enables clients to achieve their optimal personalization. Extensive experimental results and in-depth analysis demonstrate the effectiveness of FedEgo.  ( 2 min )

To improve the security and reliability of wind energy production, short-term forecasting has become of utmost importance. This study focuses on multi-step spatio-temporal wind speed forecasting for the Norwegian continental shelf. A graph neural network (GNN) architecture was used to extract spatial dependencies, with different update functions to learn temporal correlations. These update functions were implemented using different neural network architectures. One such architecture, the Transformer, has become increasingly popular for sequence modelling in recent years. Various alterations of the original architecture have been proposed to better facilitate time-series forecasting, of which this study focused on the Informer, LogSparse Transformer and Autoformer. This is the first time the LogSparse Transformer and Autoformer have been applied to wind forecasting and the first time any of these or the Informer have been formulated in a spatio-temporal setting for wind forecasting. By comparing against spatio-temporal Long Short-Term Memory (LSTM) and Multi-Layer Perceptron (MLP) models, the study showed that the models using the altered Transformer architectures as update functions in GNNs were able to outperform these. Furthermore, we propose the Fast Fourier Transformer (FFTransformer), which is a novel Transformer architecture based on signal decomposition and consists of two separate streams that analyse trend and periodic components separately. The FFTransformer and Autoformer were found to achieve superior results for the 10-minute and 1-hour ahead forecasts, with the FFTransformer significantly outperforming all other models for the 4-hour ahead forecasts. Finally, by varying the degree of connectivity for the graph representations, the study explicitly demonstrates how all models were able to leverage spatial dependencies to improve local short-term wind speed forecasting.  ( 3 min )

Hate speech classification has been a long-standing problem in natural language processing. However, even though there are numerous hate speech detection methods, they usually overlook a lot of hateful statements due to them being implicit in nature. Developing datasets to aid in the task of implicit hate speech classification comes with its own challenges; difficulties are nuances in language, varying definitions of what constitutes hate speech, and the labor-intensive process of annotating such data. This had led to a scarcity of data available to train and test such systems, which gives rise to high variance problems when parameter-heavy transformer-based models are used to address the problem. In this paper, we explore various optimization and regularization techniques and develop a novel RoBERTa-based model that achieves state-of-the-art performance.  ( 2 min )

The stock market is a network which provides a platform for almost all major economic transactions. While investing in the stock market is a good idea, investing in individual stocks may not be, especially for the casual investor. Smart stock-picking requires in-depth research and plenty of dedication. Predicting this stock value offers enormous arbitrage profit opportunities. This attractiveness of finding a solution has prompted researchers to find a way past problems like volatility, seasonality, and dependence on time. This paper surveys recent literature in the domain of natural language processing and machine learning techniques used to predict stock market movements. The main contributions of this paper include the sophisticated categorizations of many recent articles and the illustration of the recent trends of research in stock market prediction and its related areas.  ( 2 min )

Federated learning (FL) aims to learn joint knowledge from a large scale of decentralized devices with labeled data in a privacy-preserving manner. However, since high-quality labeled data require expensive human intelligence and efforts, data with incorrect labels (called noisy labels) are ubiquitous in reality, which inevitably cause performance degradation. Although a lot of methods are proposed to directly deal with noisy labels, these methods either require excessive computation overhead or violate the privacy protection principle of FL. To this end, we focus on this issue in FL with the purpose of alleviating performance degradation yielded by noisy labels meanwhile guaranteeing data privacy. Specifically, we propose a Local Self-Regularization method, which effectively regularizes the local training process via implicitly hindering the model from memorizing noisy labels and explicitly narrowing the model output discrepancy between original and augmented instances using self distillation. Experimental results demonstrate that our proposed method can achieve notable resistance against noisy labels in various noise levels on three benchmark datasets. In addition, we integrate our method with existing state-of-the-arts and achieve superior performance on the real-world dataset Clothing1M. The code is available at https://github.com/Sprinter1999/FedLSR.  ( 3 min )

The causal effect of showing an ad to a potential customer versus not, commonly referred to as "incrementality", is the fundamental question of advertising effectiveness. In digital advertising three major puzzle pieces are central to rigorously quantifying advertising incrementality: ad buying/bidding/pricing, attribution, and experimentation. Building on the foundations of machine learning and causal econometrics, we propose a methodology that unifies these three concepts into a computationally viable model of both bidding and attribution which spans the randomization, training, cross validation, scoring, and conversion attribution of advertising's causal effects. Implementation of this approach is likely to secure a significant improvement in the return on investment of advertising.  ( 2 min )

Limited compute and communication capabilities of edge users create a significant bottleneck for federated learning (FL) of large models. We consider a realistic, but much less explored, cross-device FL setting in which no client has the capacity to train a full large model nor is willing to share any intermediate activations with the server. To this end, we present Principal Sub-Model (PriSM) training methodology, which leverages models low-rank structure and kernel orthogonality to train sub-models in the orthogonal kernel space. More specifically, by applying singular value decomposition (SVD) to original kernels in the server model, PriSM first obtains a set of principal orthogonal kernels in which each one is weighed by its singular value. Thereafter, PriSM utilizes our novel sampling strategy that selects different subsets of the principal kernels independently to create sub-models for clients. Importantly, a kernel with a large singular value is assigned with a high sampling probability. Thus, each sub-model is a low-rank approximation of the full large model, and all clients together achieve the near full-model training. Our extensive evaluations on multiple datasets in various resource-constrained settings show that PriSM can yield an improved performance of up to 10% compared to existing alternatives, with only around 20% sub-model training.  ( 2 min )

Active Domain Adaptation (ADA) queries the label of selected target samples to help adapting a model from a related source domain to a target domain. It has attracted increasing attention recently due to its promising performance with minimal labeling cost. Nevertheless, existing ADA methods have not fully exploited the local context of queried data, which is important to ADA, especially when the domain gap is large. In this paper, we propose a novel framework of Local context-aware Active Domain Adaptation (LADA), which is composed of two key modules. The Local context-aware Active Selection (LAS) module selects target samples whose class probability predictions are inconsistent with their neighbors. The Local context-aware Model Adaptation (LMA) module refines a model with both queried samples and their expanded neighbors, regularized by a context-preserving loss. Extensive experiments show that LAS selects more informative samples than existing active selection strategies. Furthermore, equipped with LMA, the full LADA method outperforms state-of-the-art ADA solutions on various benchmarks. Code is available at https://github.com/tsun/LADA.  ( 2 min )

Deep learning is usually data starved, and the unsupervised domain adaptation (UDA) is developed to introduce the knowledge in the labeled source domain to the unlabeled target domain. Recently, deep self-training presents a powerful means for UDA, involving an iterative process of predicting the target domain and then taking the confident predictions as hard pseudo-labels for retraining. However, the pseudo-labels are usually unreliable, thus easily leading to deviated solutions with propagated errors. In this paper, we resort to the energy-based model and constrain the training of the unlabeled target sample with an energy function minimization objective. It can be achieved via a simple additional regularization or an energy-based loss. This framework allows us to gain the benefits of the energy-based model, while retaining strong discriminative performance following a plug-and-play fashion. The convergence property and its connection with classification expectation minimization are investigated. We deliver extensive experiments on the most popular and large-scale UDA benchmarks of image classification as well as semantic segmentation to demonstrate its generality and effectiveness.  ( 2 min )

In this paper, we present a two stage model for multi-hop question answering. The first stage is a hierarchical graph network, which is used to reason over multi-hop question and is capable to capture different levels of granularity using the nature structure(i.e., paragraphs, questions, sentences and entities) of documents. The reasoning process is convert to node classify task(i.e., paragraph nodes and sentences nodes). The second stage is a language model fine-tuning task. In a word, stage one use graph neural network to select and concatenate support sentences as one paragraph, and stage two find the answer span in language model fine-tuning paradigm.  ( 2 min )

In this paper, we study the Tikhonov regularization scheme in Hilbert scales for the nonlinear statistical inverse problem with a general noise. The regularizing norm in this scheme is stronger than the norm in Hilbert space. We focus on developing a theoretical analysis for this scheme based on the conditional stability estimates. We utilize the concept of the distance function to establish the high probability estimates of the direct and reconstruction error in Reproducing kernel Hilbert space setting. Further, the explicit rates of convergence in terms of sample size are established for the oversmoothing case and the regular case over the regularity class defined through appropriate source condition. Our results improve and generalize previous results obtained in related settings.  ( 2 min )

Enhancing model prediction confidence on unlabeled target data is an important objective in Unsupervised Domain Adaptation (UDA). In this paper, we explore adversarial training on penultimate activations, ie, input features of the final linear classification layer. We show that this strategy is more efficient and better correlated with the objective of boosting prediction confidence than adversarial training on input images or intermediate features, as used in previous works. Furthermore, with activation normalization commonly used in domain adaptation to reduce domain gap, we derive two variants and systematically analyze the effects of normalization on our adversarial training. This is illustrated both in theory and through empirical analysis on real adaptation tasks. Extensive experiments are conducted on popular UDA benchmarks under both standard setting and source-data free setting. The results validate that our method achieves the best scores against previous arts.  ( 2 min )

Dwarf galaxies are small, dark matter-dominated galaxies, some of which are embedded within the Milky Way. Their lack of baryonic matter (e.g., stars and gas) makes them perfect test beds for probing the properties of dark matter -- understanding the spatial dark matter distribution in these systems can be used to constrain microphysical dark matter interactions that influence the formation and evolution of structures in our Universe. We introduce a new method that leverages simulation-based inference and graph-based machine learning in order to infer the dark matter density profiles of dwarf galaxies from observable kinematics of stars gravitationally bound to these systems. Our approach aims to address some of the limitations of established methods based on dynamical Jeans modeling. We show that this novel method can place stronger constraints on dark matter profiles and, consequently, has the potential to weigh in on some of the ongoing puzzles associated with the small-scale structure of dark matter halos, such as the core-cusp discrepancy.  ( 2 min )

Multiview clustering has been extensively studied to take advantage of multi-source information to improve the clustering performance. In general, most of the existing works typically compute an n * n affinity graph by some similarity/distance metrics (e.g. the Euclidean distance) or learned representations, and explore the pairwise correlations across views. But unfortunately, a quadratic or even cubic complexity is often needed, bringing about difficulty in clustering largescale datasets. Some efforts have been made recently to capture data distribution in multiple views by selecting view-wise anchor representations with k-means, or by direct matrix factorization on the original observations. Despite the significant success, few of them have considered the view-insufficiency issue, implicitly holding the assumption that each individual view is sufficient to recover the cluster structure. Moreover, the latent integral space as well as the shared cluster structure from multiple insufficient views is not able to be simultaneously discovered. In view of this, we propose an Adaptively-weighted Integral Space for Fast Multiview Clustering (AIMC) with nearly linear complexity. Specifically, view generation models are designed to reconstruct the view observations from the latent integral space with diverse adaptive contributions. Meanwhile, a centroid representation with orthogonality constraint and cluster partition are seamlessly constructed to approximate the latent integral space. An alternate minimizing algorithm is developed to solve the optimization problem, which is proved to have linear time complexity w.r.t. the sample size. Extensive experiments conducted on several realworld datasets confirm the superiority of the proposed AIMC method compared with the state-of-the-art methods.  ( 3 min )

In federated learning, most existing techniques for robust aggregation against Byzantine attacks are designed for the IID setting, i.e., the data distributions for clients are independent and identically distributed. In this paper, we address label skewness, a more realistic and challenging non-IID setting, where each client only has access to a few classes of data. In this setting, state-of-the-art techniques suffer from selection bias, leading to significant performance drop for particular classes; they are also more vulnerable to Byzantine attacks due to the increased deviation among gradients of honest clients. To address these limitations, we propose an efficient two-stage method named BOBA. Theoretically, we prove the convergence of BOBA with an error of optimal order. Empirically, we verify the superior unbiasedness and robustness of BOBA across a wide range of models and data sets against various baselines.  ( 2 min )

Recent work has shown a strong theoretical connection between variational autoencoders (VAEs) and the rate distortion theory. Motivated by this, we consider the problem of lossy image compression from the perspective of generative modeling. Starting from ResNet VAEs, which are originally designed for data (image) distribution modeling, we redesign their latent variable model using a quantization-aware posterior and prior, enabling easy quantization and entropy coding for image compression. Along with improved neural network blocks, we present a powerful and efficient class of lossy image coders, outperforming previous methods on natural image (lossy) compression. Our model compresses images in a coarse-to-fine fashion and supports parallel encoding and decoding, leading to fast execution on GPUs.  ( 2 min )